AFLOW
Functions | Variables
aflow_xpseudopotentials_data.cpp File Reference

Functions

x vTITEL push_back ("USAg")
 
x species push_back ("Ag")
 
x species_Z push_back (47)
 
x species_pp_type push_back ("LDA")
 
x species_pp_version push_back ("Ag:LDA:01Apr2000")
 
x species_pp_AUID push_back ("639bb9917452d998")
 
x species_pp_groundstate_energy push_back (-3.744496)
 
x species_pp_groundstate_structure push_back ("A1")
 
x vEATOM push_back (1281.8324)
 
x vRMAX push_back (3.431)
 
x vLEXCH push_back ("CA")
 
vxpseudopotential push_back (x)
 
x vTITEL push_back ("USAl")
 
x species push_back ("Al")
 
x species_Z push_back (13)
 
x species_pp_version push_back ("Al:LDA:01Apr2000")
 
x species_pp_AUID push_back ("ec638285f61e73c3")
 
x species_pp_groundstate_energy push_back (-4.231)
 
x vEATOM push_back (68.9393)
 
x vRMAX push_back (1.85)
 
x species_pp_AUID push_back ("624cbf44af81780c")
 
x vRMAX push_back (4.056)
 
x vTITEL push_back ("USAr")
 
x species push_back ("Ar")
 
x species_Z push_back (18)
 
x species_pp_version push_back ("Ar:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d02666913ee8c984")
 
x species_pp_groundstate_energy push_back (-123456)
 
x species_pp_groundstate_structure push_back ("N/A_d02666913ee8c984")
 
x vEATOM push_back (624.2154)
 
x vRMAX push_back (2.65)
 
x vTITEL push_back ("USAs")
 
x species push_back ("As")
 
x species_Z push_back (33)
 
x species_pp_version push_back ("As:LDA:01Apr2000")
 
x species_pp_AUID push_back ("6175700952b14721")
 
x species_pp_groundstate_structure push_back ("N/A_6175700952b14721")
 
x vEATOM push_back (230.9698)
 
x vTITEL push_back ("USAu")
 
x species push_back ("Au")
 
x species_Z push_back (79)
 
x species_pp_version push_back ("Au:LDA:01Apr2000")
 
x species_pp_AUID push_back ("c42e6bdfe7e7024e")
 
x vEATOM push_back (1353.1269)
 
x vTITEL push_back ("USBa")
 
x species push_back ("Ba")
 
x species_Z push_back (56)
 
x species_pp_version push_back ("Ba:LDA:01Apr2000")
 
x species_pp_AUID push_back ("b5d1dafcf2f8d798")
 
x species_pp_groundstate_energy push_back (-2.19536)
 
x species_pp_groundstate_structure push_back ("A2")
 
x vEATOM push_back (538.619)
 
x vTITEL push_back ("USBe")
 
x species push_back ("Be")
 
x species_Z push_back (4)
 
x species_pp_version push_back ("Be:LDA:01Apr2000")
 
x species_pp_AUID push_back ("653b8d1063d6b4e0")
 
x species_pp_groundstate_structure push_back ("A3")
 
x vEATOM push_back (33.5025)
 
x vTITEL push_back ("USBi")
 
x species push_back ("Bi")
 
x species_Z push_back (83)
 
x species_pp_version push_back ("Bi:LDA:01Apr2000")
 
x species_pp_AUID push_back ("7706078a4f3b44bd")
 
x species_pp_groundstate_structure push_back ("N/A_7706078a4f3b44bd")
 
x vEATOM push_back (1944.5848)
 
x species_pp_AUID push_back ("8758bd99a53975ab")
 
x species_pp_groundstate_structure push_back ("N/A_8758bd99a53975ab")
 
x vEATOM push_back (356.0823)
 
x vTITEL push_back ("USB")
 
x species push_back ("B")
 
x species_Z push_back (5)
 
x species_pp_version push_back ("B:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d6331b10128d6537")
 
x species_pp_groundstate_structure push_back ("N/A_d6331b10128d6537")
 
x vEATOM push_back (70.1632)
 
x vTITEL push_back ("USBr")
 
x species push_back ("Br")
 
x species_Z push_back (35)
 
x species_pp_version push_back ("Br:LDA:01Apr2000")
 
x species_pp_AUID push_back ("43fcb04cd5b45940")
 
x species_pp_groundstate_structure push_back ("N/A_43fcb04cd5b45940")
 
x vEATOM push_back (411.3699)
 
x vTITEL push_back ("USB_s")
 
x species_pp push_back ("B_s")
 
x species_pp_version push_back ("B_s:LDA:01Apr2000")
 
x species_pp_AUID push_back ("691e76d3ce19f274")
 
x species_pp_groundstate_structure push_back ("N/A_691e76d3ce19f274")
 
x vTITEL push_back ("USCa")
 
x species push_back ("Ca")
 
x species_Z push_back (20)
 
x species_pp_version push_back ("Ca:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d85b55fde567529b")
 
x vEATOM push_back (195.0664)
 
x species_pp_AUID push_back ("e65bce3da30c5d46")
 
x vEATOM push_back (629.2095)
 
x vTITEL push_back ("USCd")
 
x species push_back ("Cd")
 
x species_Z push_back (48)
 
x species_pp_version push_back ("Cd:LDA:01Apr2000")
 
x species_pp_AUID push_back ("07875e5a0789cd01")
 
x species_pp_groundstate_energy push_back (-1.53073)
 
x vEATOM push_back (1499.9103)
 
x vTITEL push_back ("USCl")
 
x species push_back ("Cl")
 
x species_Z push_back (17)
 
x species_pp_version push_back ("Cl:LDA:01Apr2000")
 
x species_pp_AUID push_back ("df6024f6ee021cf9")
 
x species_pp_groundstate_structure push_back ("N/A_df6024f6ee021cf9")
 
x vEATOM push_back (413.6826)
 
x vTITEL push_back ("USCo")
 
x species push_back ("Co")
 
x species_Z push_back (27)
 
x species_pp_version push_back ("Co:LDA:01Apr2000")
 
x species_pp_AUID push_back ("41f6635e51e063f9")
 
x species_pp_groundstate_energy push_back (-8.1376)
 
x vEATOM push_back (984.849)
 
x vTITEL push_back ("USC")
 
x species push_back ("C")
 
x species_Z push_back (6)
 
x species_pp_version push_back ("C:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d951d3c4d963900a")
 
x species_pp_groundstate_energy push_back (-10.15636)
 
x species_pp_groundstate_structure push_back ("A9")
 
x vEATOM push_back (145.3474)
 
x vTITEL push_back ("USCr")
 
x species push_back ("Cr")
 
x species_Z push_back (24)
 
x species_pp_version push_back ("Cr:LDA:01Apr2000")
 
x species_pp_AUID push_back ("7ab8ddc788e0ece9")
 
x vEATOM push_back (491.3656)
 
x vTITEL push_back ("USC_s")
 
x species_pp push_back ("C_s")
 
x species_pp_version push_back ("C_s:LDA:01Apr2000")
 
x species_pp_AUID push_back ("73c35c1982ecc74b")
 
x vTITEL push_back ("USCs")
 
x species push_back ("Cs")
 
x species_Z push_back (55)
 
x species_pp_version push_back ("Cs:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d4564ab900b08de9")
 
x species_pp_groundstate_structure push_back ("N/A_d4564ab900b08de9")
 
x vEATOM push_back (162.4381)
 
x vRMAX push_back (6.656)
 
x species_pp_AUID push_back ("26ec55c896795e1d")
 
x species_pp_groundstate_structure push_back ("N/A_26ec55c896795e1d")
 
x vEATOM push_back (370.071)
 
x vTITEL push_back ("USCu")
 
x species push_back ("Cu")
 
x species_Z push_back (29)
 
x species_pp_version push_back ("Cu:LDA:01Apr2000")
 
x species_pp_AUID push_back ("88d5d10238695c60")
 
x vEATOM push_back (1420.4336)
 
x vTITEL push_back ("USFe")
 
x species push_back ("Fe")
 
x species_Z push_back (26)
 
x species_pp_version push_back ("Fe:LDA:01Apr2000")
 
x species_pp_AUID push_back ("53451df4122ca435")
 
x species_pp_groundstate_energy push_back (-9.27793)
 
x vEATOM push_back (796.5147)
 
x vTITEL push_back ("USF")
 
x species push_back ("F")
 
x species_Z push_back (9)
 
x species_pp_version push_back ("F:LDA:01Apr2000")
 
x species_pp_AUID push_back ("7d78af3ddadedc15")
 
x species_pp_groundstate_structure push_back ("N/A_7d78af3ddadedc15")
 
x vEATOM push_back (651.277)
 
x vTITEL push_back ("USF_s")
 
x species_pp push_back ("F_s")
 
x species_pp_version push_back ("F_s:LDA:01Apr2000")
 
x species_pp_AUID push_back ("f8e61fafbbc42286")
 
x species_pp_groundstate_structure push_back ("N/A_f8e61fafbbc42286")
 
x vEATOM push_back (639.4032)
 
x vTITEL push_back ("USGa")
 
x species push_back ("Ga")
 
x species_Z push_back (31)
 
x species_pp_version push_back ("Ga:LDA:01Apr2000")
 
x species_pp_AUID push_back ("187da9e099fe4582")
 
x species_pp_groundstate_structure push_back ("N/A_187da9e099fe4582")
 
x vEATOM push_back (1667.3148)
 
x species_pp_AUID push_back ("f27f7a21bebee0b6")
 
x species_pp_groundstate_structure push_back ("N/A_f27f7a21bebee0b6")
 
x vEATOM push_back (144.6316)
 
x vTITEL push_back ("USGe")
 
x species push_back ("Ge")
 
x species_Z push_back (32)
 
x species_pp_version push_back ("Ge:LDA:01Apr2000")
 
x species_pp_AUID push_back ("60aa6eae51da5ce4")
 
x species_pp_groundstate_energy push_back (-5.19244)
 
x species_pp_groundstate_structure push_back ("A4")
 
x vEATOM push_back (180.9206)
 
x vTITEL push_back ("USH")
 
x species push_back ("H")
 
x species_Z push_back (1)
 
x species_pp_version push_back ("H:LDA:01Apr2000")
 
x species_pp_AUID push_back ("74edc4d2a9d2d570")
 
x species_pp_groundstate_structure push_back ("N/A_74edc4d2a9d2d570")
 
x vEATOM push_back (21.7477)
 
x vRMAX push_back (3)
 
x species_pp_AUID push_back ("4a4f3563702289f2")
 
x species_pp_groundstate_structure push_back ("N/A_4a4f3563702289f2")
 
x vEATOM push_back (12.1324)
 
x species_pp_AUID push_back ("065cd13e9f13c85d")
 
x species_pp_groundstate_structure push_back ("N/A_065cd13e9f13c85d")
 
x vEATOM push_back (5.823)
 
x vTITEL push_back ("USHf")
 
x species push_back ("Hf")
 
x species_Z push_back (72)
 
x species_pp_version push_back ("Hf:LDA:01Apr2000")
 
x species_pp_AUID push_back ("1af9281ed7be5121")
 
x vEATOM push_back (202.1673)
 
x vTITEL push_back ("USHg")
 
x species push_back ("Hg")
 
x species_Z push_back (80)
 
x species_pp_version push_back ("Hg:LDA:01Apr2000")
 
x species_pp_AUID push_back ("03e3289690e1f860")
 
x species_pp_groundstate_energy push_back (-0.958689)
 
x species_pp_groundstate_structure push_back ("A10(A3)")
 
x vEATOM push_back (1579.3905)
 
x species_pp_AUID push_back ("ac1f3cd0d6a33316")
 
x species_pp_groundstate_structure push_back ("N/A_ac1f3cd0d6a33316")
 
x vTITEL push_back ("USIn")
 
x species push_back ("In")
 
x species_Z push_back (49)
 
x species_pp_version push_back ("In:LDA:01Apr2000")
 
x species_pp_AUID push_back ("561944a648769209")
 
x species_pp_groundstate_structure push_back ("N/A_561944a648769209")
 
x vEATOM push_back (1462.7799)
 
x species_pp_AUID push_back ("38bb66b66c502beb")
 
x species_pp_groundstate_structure push_back ("N/A_38bb66b66c502beb")
 
x vEATOM push_back (193.287)
 
x vTITEL push_back ("USI")
 
x species push_back ("I")
 
x species_Z push_back (53)
 
x species_pp_version push_back ("I:LDA:01Apr2000")
 
x species_pp_AUID push_back ("338de127dfa56c08")
 
x species_pp_groundstate_structure push_back ("N/A_338de127dfa56c08")
 
x vEATOM push_back (434.8256)
 
x vTITEL push_back ("USIr")
 
x species push_back ("Ir")
 
x species_Z push_back (77)
 
x species_pp_version push_back ("Ir:LDA:01Apr2000")
 
x species_pp_AUID push_back ("0d6f43382108d13d")
 
x vEATOM push_back (919.6515)
 
x vTITEL push_back ("USK")
 
x species push_back ("K")
 
x species_Z push_back (19)
 
x species_pp_version push_back ("K:LDA:01Apr2000")
 
x species_pp_AUID push_back ("bc9d6fb83de4a3e6")
 
x vEATOM push_back (152.2493)
 
x species_pp_AUID push_back ("828b9d8df4c3212b")
 
x vEATOM push_back (474.4308)
 
x vTITEL push_back ("USKr")
 
x species push_back ("Kr")
 
x species_Z push_back (36)
 
x species_pp_version push_back ("Kr:LDA:01Apr2000")
 
x species_pp_AUID push_back ("af69c2573427c4dc")
 
x species_pp_groundstate_structure push_back ("N/A_af69c2573427c4dc")
 
x vEATOM push_back (536.4416)
 
x species_pp_AUID push_back ("df36a4e58e2ce8a3")
 
x species_pp_groundstate_structure push_back ("N/A_df36a4e58e2ce8a3")
 
x vEATOM push_back (14.417)
 
x vRMAX push_back (7.685)
 
x vTITEL push_back ("USLi")
 
x species push_back ("Li")
 
x species_pp_version push_back ("Li:LDA:01Apr2000")
 
x species_pp_AUID push_back ("1c81ce7af52fff4e")
 
x species_pp_groundstate_structure push_back ("A2*")
 
x species_pp_AUID push_back ("bea66b246b1c188f")
 
x species_pp_groundstate_structure push_back ("N/A_bea66b246b1c188f")
 
x vTITEL push_back ("USMg")
 
x species push_back ("Mg")
 
x species_Z push_back (12)
 
x species_pp_version push_back ("Mg:LDA:01Apr2000")
 
x species_pp_AUID push_back ("78efd19d72d98cb8")
 
x vEATOM push_back (41.1333)
 
x species_pp_AUID push_back ("61fec4224ab4cab8")
 
x species_pp_AUID push_back ("1308594682e50447")
 
x vEATOM push_back (925.6982)
 
x vTITEL push_back ("USMn")
 
x species push_back ("Mn")
 
x species_Z push_back (25)
 
x species_pp_version push_back ("Mn:LDA:01Apr2000")
 
x species_pp_AUID push_back ("86604354cd00dea2")
 
x species_pp_groundstate_structure push_back ("N/A_86604354cd00dea2")
 
x vEATOM push_back (630.4458)
 
x species_pp_AUID push_back ("9cb565e70151b871")
 
x species_pp_groundstate_structure push_back ("N/A_9cb565e70151b871")
 
x vEATOM push_back (1917.7914)
 
x vTITEL push_back ("USMo")
 
x species push_back ("Mo")
 
x species_Z push_back (42)
 
x species_pp_version push_back ("Mo:LDA:01Apr2000")
 
x species_pp_AUID push_back ("c56388dcfe8555c0")
 
x species_pp_groundstate_energy push_back (-12.1515)
 
x species_pp_AUID push_back ("097174f08d663402")
 
x species_pp_groundstate_energy push_back (-11.7663)
 
x vEATOM push_back (1363.5863)
 
x vTITEL push_back ("NCNa")
 
x species push_back ("Na")
 
x species_Z push_back (11)
 
x species_pp_version push_back ("Na:LDA:01Apr2000")
 
x species_pp_AUID push_back ("d7694c246a0273a3")
 
x species_pp_groundstate_structure push_back ("N/A_d7694c246a0273a3")
 
x vTITEL push_back ("USNa")
 
x species_pp_AUID push_back ("dd66cbd5fb6f15d9")
 
x species_pp_groundstate_structure push_back ("N/A_dd66cbd5fb6f15d9")
 
x species_pp_AUID push_back ("09046b7179097410")
 
x species_pp_groundstate_structure push_back ("N/A_09046b7179097410")
 
x vEATOM push_back (721.3)
 
x vTITEL push_back ("USNb")
 
x species push_back ("Nb")
 
x species_Z push_back (41)
 
x species_pp_version push_back ("Nb:LDA:01Apr2000")
 
x species_pp_AUID push_back ("31fbbfcce7b1cf49")
 
x vEATOM push_back (343.5564)
 
x species_pp_AUID push_back ("31ac6525497e7fb5")
 
x vEATOM push_back (1123.9911)
 
x vTITEL push_back ("USNe")
 
x species push_back ("Ne")
 
x species_Z push_back (10)
 
x species_pp_version push_back ("Ne:LDA:01Apr2000")
 
x species_pp_AUID push_back ("4bda2c3e931df0db")
 
x vEATOM push_back (927.2544)
 
x vTITEL push_back ("USNi")
 
x species push_back ("Ni")
 
x species_Z push_back (28)
 
x species_pp_version push_back ("Ni:LDA:01Apr2000")
 
x species_pp_AUID push_back ("134ab84006e2f008")
 
x species_pp_groundstate_energy push_back (-6.586101)
 
x vEATOM push_back (1197.3512)
 
x vTITEL push_back ("USN")
 
x species push_back ("N")
 
x species_Z push_back (7)
 
x species_pp_version push_back ("N:LDA:01Apr2000")
 
x species_pp_AUID push_back ("276e909660f3ef22")
 
x species_pp_groundstate_structure push_back ("N/A_276e909660f3ef22")
 
x vEATOM push_back (261.5416)
 
x vTITEL push_back ("USN_s")
 
x species_pp push_back ("N_s")
 
x species_pp_version push_back ("N_s:LDA:01Apr2000")
 
x species_pp_AUID push_back ("afe2ea3dc40fcbdb")
 
x species_pp_groundstate_structure push_back ("N/A_afe2ea3dc40fcbdb")
 
x vEATOM push_back (260.0508)
 
x vTITEL push_back ("USO")
 
x species push_back ("O")
 
x species_Z push_back (8)
 
x species_pp_version push_back ("O:LDA:01Apr2000")
 
x species_pp_AUID push_back ("8e95e1160f67e677")
 
x species_pp_groundstate_structure push_back ("N/A_8e95e1160f67e677")
 
x vEATOM push_back (427.4741)
 
x vTITEL push_back ("USO_s")
 
x species_pp push_back ("O_s")
 
x species_pp_version push_back ("O_s:LDA:01Apr2000")
 
x species_pp_AUID push_back ("52427dc57b32a100")
 
x species_pp_groundstate_structure push_back ("N/A_52427dc57b32a100")
 
x vEATOM push_back (423.4034)
 
x vTITEL push_back ("USOs")
 
x species push_back ("Os")
 
x species_Z push_back (76)
 
x species_pp_version push_back ("Os:LDA:01Apr2000")
 
x species_pp_AUID push_back ("8c0f432aa073c44a")
 
x vEATOM push_back (732.8093)
 
x vTITEL push_back ("USPb_d")
 
x species push_back ("Pb")
 
x species_Z push_back (82)
 
x species_pp push_back ("Pb_d")
 
x species_pp_version push_back ("Pb_d:LDA:01Apr2000")
 
x species_pp_AUID push_back ("58341640c6c638ed")
 
x vEATOM push_back (1932.2852)
 
x vTITEL push_back ("USPb")
 
x species_pp_version push_back ("Pb:LDA:01Apr2000")
 
x species_pp_AUID push_back ("626de6bdde387007")
 
x vEATOM push_back (270.2479)
 
x vTITEL push_back ("USPd")
 
x species push_back ("Pd")
 
x species_Z push_back (46)
 
x species_pp_version push_back ("Pd:LDA:01Apr2000")
 
x species_pp_AUID push_back ("552d7d192268351d")
 
x vEATOM push_back (1063.0176)
 
x vTITEL push_back ("USP")
 
x species push_back ("P")
 
x species_Z push_back (15)
 
x species_pp_version push_back ("P:LDA:01Apr2000")
 
x species_pp_AUID push_back ("6e885c4fb160579c")
 
x species_pp_groundstate_structure push_back ("N/A_6e885c4fb160579c")
 
x vEATOM push_back (185.9163)
 
x vTITEL push_back ("USPt")
 
x species push_back ("Pt")
 
x species_Z push_back (78)
 
x species_pp_version push_back ("Pt:LDA:01Apr2000")
 
x species_pp_AUID push_back ("129e32c460592b3d")
 
x species_pp_groundstate_energy push_back (-7.42489)
 
x vEATOM push_back (1129.7465)
 
x vTITEL push_back ("USRb")
 
x species push_back ("Rb")
 
x species_Z push_back (37)
 
x species_pp_version push_back ("Rb:LDA:01Apr2000")
 
x species_pp_AUID push_back ("40bc918883f81068")
 
x species_pp_groundstate_structure push_back ("N/A_40bc918883f81068")
 
x vEATOM push_back (159.4732)
 
x species_pp_AUID push_back ("375397ff589aa867")
 
x species_pp_groundstate_structure push_back ("N/A_375397ff589aa867")
 
x vEATOM push_back (417.3018)
 
x species_pp_AUID push_back ("a614e02bf7a3817f")
 
x species_pp_groundstate_structure push_back ("N/A_a614e02bf7a3817f")
 
x vEATOM push_back (15.3793)
 
x vRMAX push_back (8.159)
 
x vTITEL push_back ("USRe")
 
x species push_back ("Re")
 
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x species_pp_version push_back ("Rn_d_GW:PAW_PBE:14Apr2014")
 
x species_pp_AUID push_back ("abe3f353764b7e31")
 
x species_pp_groundstate_structure push_back ("N/A_abe3f353764b7e31")
 
x vEATOM push_back (3030.713)
 
x vTITEL push_back ("PAW_PBERn28Aug2006")
 
x species_pp_version push_back ("Rn:PAW_PBE:28Aug2006")
 
x species_pp_AUID push_back ("24f5e31bf1323508")
 
x species_pp_groundstate_structure push_back ("N/A_24f5e31bf1323508")
 
x vTITEL push_back ("PAW_PBERn_sv_GW14Apr2014")
 
x species_pp_version push_back ("Rn_sv_GW:PAW_PBE:14Apr2014")
 
x species_pp_AUID push_back ("fd5b919041e7ced1")
 
x species_pp_groundstate_structure push_back ("N/A_fd5b919041e7ced1")
 
x vEATOM push_back (7927.0395)
 
x vTITEL push_back ("PAW_PBERu04Feb2005")
 
x species_pp_version push_back ("Ru:PAW_PBE:04Feb2005")
 
x species_pp_AUID push_back ("ee46e79f573bbba1")
 
x vTITEL push_back ("PAW_PBERu_pv28Jan2005")
 
x species_pp_version push_back ("Ru_pv:PAW_PBE:28Jan2005")
 
x species_pp_AUID push_back ("6a824616a7311021")
 
x vEATOM push_back (1873.4746)
 
x vTITEL push_back ("PAW_PBERu_sv_GW05Dec2013")
 
x species_pp_version push_back ("Ru_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("c476a1b5dba68ade")
 
x vEATOM push_back (2594.8033)
 
x vTITEL push_back ("PAW_GGARu_sv28Jan2005")
 
x species_pp_version push_back ("Ru_sv:PAW_GGA:28Jan2005")
 
x species_pp_AUID push_back ("1550a87ae48844e0")
 
x vTITEL push_back ("PAW_PBESb_d_GW15Mar2013")
 
x species_pp_version push_back ("Sb_d_GW:PAW_PBE:15Mar2013")
 
x species_pp_AUID push_back ("4f26fc9dd3fb360f")
 
x species_pp_groundstate_structure push_back ("N/A_4f26fc9dd3fb360f")
 
x vEATOM push_back (2243.711)
 
x vTITEL push_back ("PAW_PBESb_GW21Mar2012")
 
x species_pp_version push_back ("Sb_GW:PAW_PBE:21Mar2012")
 
x species_pp_AUID push_back ("3fec6f2ffb9c9ff7")
 
x species_pp_groundstate_structure push_back ("N/A_3fec6f2ffb9c9ff7")
 
x species_pp_AUID push_back ("bbf81761207d2817")
 
x vTITEL push_back ("PAW_PBESb_sv_GW22Nov2013")
 
x species_pp_version push_back ("Sb_sv_GW:PAW_PBE:22Nov2013")
 
x species_pp_AUID push_back ("1e481bb188c0855d")
 
x species_pp_groundstate_structure push_back ("N/A_1e481bb188c0855d")
 
x vEATOM push_back (6571.3498)
 
x vTITEL push_back ("PAW_PBESc04Feb2005")
 
x species_pp_version push_back ("Sc:PAW_PBE:04Feb2005")
 
x species_pp_AUID push_back ("69bd66903db1e199")
 
x vTITEL push_back ("PAW_PBESc_sv_GW05Dec2013")
 
x species_pp_version push_back ("Sc_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("bbde08d55886a708")
 
x vEATOM push_back (1270.82)
 
x species_pp_AUID push_back ("83d4f13df3294a60")
 
x vTITEL push_back ("PAW_PBESe_GW20Mar2012")
 
x species_pp_version push_back ("Se_GW:PAW_PBE:20Mar2012")
 
x species_pp_AUID push_back ("e07be7e8f885f5e4")
 
x species_pp_groundstate_structure push_back ("N/A_e07be7e8f885f5e4")
 
x species_pp_AUID push_back ("00143077dee7333f")
 
x vTITEL push_back ("PAW_PBESe_sv_GW21Nov2013")
 
x species_pp_version push_back ("Se_sv_GW:PAW_PBE:21Nov2013")
 
x species_pp_AUID push_back ("b04f2b0d4828a903")
 
x species_pp_groundstate_structure push_back ("N/A_b04f2b0d4828a903")
 
x vEATOM push_back (10170.6633)
 
x vTITEL push_back ("PAW_PBES_GW19Mar2012")
 
x species_pp_version push_back ("S_GW:PAW_PBE:19Mar2012")
 
x species_pp_AUID push_back ("ae81169b759a46a8")
 
x species_pp_groundstate_structure push_back ("N/A_ae81169b759a46a8")
 
x species_pp_AUID push_back ("40679994b360338c")
 
x species_pp_groundstate_structure push_back ("N/A_40679994b360338c")
 
x vTITEL push_back ("PAW_PBESi_GW04May2012")
 
x species_pp_version push_back ("Si_GW:PAW_PBE:04May2012")
 
x species_pp_AUID push_back ("6af63b41a1e485ff")
 
x species_pp_groundstate_structure push_back ("N/A_6af63b41a1e485ff")
 
x species_pp_AUID push_back ("afc7580b135e98ce")
 
x vTITEL push_back ("PAW_PBESi_sv_GW29Sep2009")
 
x species_pp_version push_back ("Si_sv_GW:PAW_PBE:29Sep2009")
 
x species_pp_AUID push_back ("9af06dcd5ce81bc3")
 
x species_pp_groundstate_structure push_back ("N/A_9af06dcd5ce81bc3")
 
x vEATOM push_back (2779.1055)
 
x species_pp_AUID push_back ("5b4edfcf9bf433f3")
 
x species_pp_groundstate_structure push_back ("N/A_5b4edfcf9bf433f3")
 
x vTITEL push_back ("PAW_PBESm21Nov2014")
 
x species_pp_version push_back ("Sm:PAW_PBE:21Nov2014")
 
x species_pp_AUID push_back ("0985a2959768335b")
 
x species_pp_groundstate_structure push_back ("N/A_0985a2959768335b")
 
x vTITEL push_back ("PAW_PBESn_d_GW15Mar2013")
 
x species_pp_version push_back ("Sn_d_GW:PAW_PBE:15Mar2013")
 
x species_pp_AUID push_back ("9a9ccd880f536416")
 
x species_pp_groundstate_structure push_back ("N/A_9a9ccd880f536416")
 
x species_pp_AUID push_back ("6431a791389bb4f7")
 
x species_pp_AUID push_back ("4ddcdf83c7589054")
 
x vTITEL push_back ("PAW_PBESn_sv_GW22Nov2013")
 
x species_pp_version push_back ("Sn_sv_GW:PAW_PBE:22Nov2013")
 
x species_pp_AUID push_back ("e1f5830bb7259c8f")
 
x species_pp_groundstate_structure push_back ("N/A_e1f5830bb7259c8f")
 
x vEATOM push_back (5862.8354)
 
x vTITEL push_back ("PAW_PBES06Sep2000")
 
x species_pp_version push_back ("S:PAW_PBE:06Sep2000")
 
x species_pp_AUID push_back ("a18b03f7564daaaa")
 
x vTITEL push_back ("PAW_PBESr_sv_GW23Mar2010")
 
x species_pp_version push_back ("Sr_sv_GW:PAW_PBE:23Mar2010")
 
x species_pp_AUID push_back ("a447636c05ea63c7")
 
x vEATOM push_back (838.2651)
 
x species_pp_AUID push_back ("403b3e0afc9132cc")
 
x species_pp_AUID push_back ("096d94d0306813d6")
 
x species_pp_AUID push_back ("2287798c5502b426")
 
x vTITEL push_back ("PAW_PBETa_sv_GW23Mar2010")
 
x species_pp_version push_back ("Ta_sv_GW:PAW_PBE:23Mar2010")
 
x species_pp_AUID push_back ("bcd3b7b7689d66d7")
 
x vEATOM push_back (1591.0418)
 
x species_pp_AUID push_back ("ed7ad539b010c52e")
 
x species_pp_groundstate_structure push_back ("N/A_ed7ad539b010c52e")
 
x vTITEL push_back ("PAW_PBETb23Dec2003")
 
x species_pp_version push_back ("Tb:PAW_PBE:23Dec2003")
 
x species_pp_AUID push_back ("aa67c66116f49cc9")
 
x species_pp_groundstate_structure push_back ("N/A_aa67c66116f49cc9")
 
x vEATOM push_back (3532.1156)
 
x vTITEL push_back ("PAW_PBETc04Feb2005")
 
x species_pp_version push_back ("Tc:PAW_PBE:04Feb2005")
 
x species_pp_AUID push_back ("5751220a43dddd9b")
 
x vTITEL push_back ("PAW_PBETc_pv04Feb2005")
 
x species_pp_version push_back ("Tc_pv:PAW_PBE:04Feb2005")
 
x species_pp_AUID push_back ("5c4bf0cceb477531")
 
x vEATOM push_back (1560.2019)
 
x vTITEL push_back ("PAW_PBETc_sv_GW05Dec2013")
 
x species_pp_version push_back ("Tc_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("69d305a31cd8c1fa")
 
x vEATOM push_back (2207.6909)
 
x vTITEL push_back ("PAW_PBETc_sv23Mar2010")
 
x species_pp_version push_back ("Tc_sv:PAW_PBE:23Mar2010")
 
x species_pp_AUID push_back ("3816a915d663bd59")
 
x vTITEL push_back ("PAW_PBETe_GW22Mar2012")
 
x species_pp_version push_back ("Te_GW:PAW_PBE:22Mar2012")
 
x species_pp_AUID push_back ("7adcd1313d1499f5")
 
x species_pp_groundstate_structure push_back ("N/A_7adcd1313d1499f5")
 
x species_pp_AUID push_back ("8d2f6568d1d06421")
 
x vTITEL push_back ("PAW_PBETe_sv_GW22Nov2013")
 
x species_pp_version push_back ("Te_sv_GW:PAW_PBE:22Nov2013")
 
x species_pp_AUID push_back ("8bae5759d6396694")
 
x species_pp_groundstate_structure push_back ("N/A_8bae5759d6396694")
 
x vEATOM push_back (7330.6851)
 
x species_pp_AUID push_back ("afbdbb60cb7fea6e")
 
x species_pp_groundstate_structure push_back ("N/A_afbdbb60cb7fea6e")
 
x species_pp_AUID push_back ("1fb4d3c05d6ae40a")
 
x species_pp_groundstate_structure push_back ("N/A_1fb4d3c05d6ae40a")
 
x species_pp_AUID push_back ("e19a9be220c9f36d")
 
x species_pp_AUID push_back ("571036b918ee987a")
 
x vTITEL push_back ("PAW_PBETi_sv_GW05Dec2013")
 
x species_pp_version push_back ("Ti_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("60802bd648654a15")
 
x vEATOM push_back (1585.8558)
 
x vTITEL push_back ("PAW_PBETi_sv26Sep2005")
 
x species_pp_version push_back ("Ti_sv:PAW_PBE:26Sep2005")
 
x species_pp_AUID push_back ("9695cfc266c5809c")
 
x vTITEL push_back ("PAW_PBETl_d_GW14Apr2014")
 
x species_pp_version push_back ("Tl_d_GW:PAW_PBE:14Apr2014")
 
x species_pp_AUID push_back ("8896eeaa0ff47c1f")
 
x species_pp_groundstate_structure push_back ("N/A_8896eeaa0ff47c1f")
 
x vEATOM push_back (2189.1943)
 
x species_pp_AUID push_back ("4f0fac6e26fd86a9")
 
x species_pp_AUID push_back ("0e2337aac65480f2")
 
x species_pp_groundstate_structure push_back ("N/A_0e2337aac65480f2")
 
x vTITEL push_back ("PAW_PBETl_sv_GW16Apr2014")
 
x species_pp_version push_back ("Tl_sv_GW:PAW_PBE:16Apr2014")
 
x species_pp_AUID push_back ("3234a754ecaba8c8")
 
x species_pp_groundstate_structure push_back ("N/A_3234a754ecaba8c8")
 
x vEATOM push_back (4750.8453)
 
x vTITEL push_back ("PAW_PBETm_320Jan2003")
 
x species_pp_version push_back ("Tm_3:PAW_PBE:20Jan2003")
 
x species_pp_AUID push_back ("79d03b938c691891")
 
x species_pp_groundstate_structure push_back ("N/A_79d03b938c691891")
 
x vTITEL push_back ("PAW_PBETm23Dec2003")
 
x species_pp_version push_back ("Tm:PAW_PBE:23Dec2003")
 
x species_pp_AUID push_back ("85bd67fcb39034b7")
 
x species_pp_groundstate_structure push_back ("N/A_85bd67fcb39034b7")
 
x species_pp_AUID push_back ("8c6fcf3cba9760b9")
 
x species_pp_groundstate_structure push_back ("N/A_8c6fcf3cba9760b9")
 
x species_pp_AUID push_back ("d7d8c006e5529a80")
 
x species_pp_groundstate_structure push_back ("N/A_d7d8c006e5529a80")
 
x species_pp_AUID push_back ("62ba629379463606")
 
x species_pp_AUID push_back ("ff7f68300ba3e357")
 
x vTITEL push_back ("PAW_PBEV_sv_GW05Dec2013")
 
x species_pp_version push_back ("V_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("72baf87216b94021")
 
x vTITEL push_back ("PAW_PBEV_sv02Aug2007")
 
x species_pp_version push_back ("V_sv:PAW_PBE:02Aug2007")
 
x species_pp_AUID push_back ("46928c16c2f8a488")
 
x species_pp_AUID push_back ("b99d5a263927c2ea")
 
x vTITEL push_back ("PAW_PBEW_sv_GW23Mar2010")
 
x species_pp_version push_back ("W_sv_GW:PAW_PBE:23Mar2010")
 
x species_pp_AUID push_back ("cdaff66d42eb21cb")
 
x vEATOM push_back (1863.8917)
 
x vTITEL push_back ("PAW_PBEW_sv04Sep2015")
 
x species_pp_version push_back ("W_sv:PAW_PBE:04Sep2015")
 
x species_pp_AUID push_back ("1d8c010cef748b9c")
 
x vTITEL push_back ("PAW_PBEXe_GW08Jan2009")
 
x species_pp_version push_back ("Xe_GW:PAW_PBE:08Jan2009")
 
x species_pp_AUID push_back ("ae23265533bce8f5")
 
x species_pp_groundstate_structure push_back ("N/A_ae23265533bce8f5")
 
x species_pp_AUID push_back ("c02f007fc5b0452c")
 
x species_pp_groundstate_structure push_back ("N/A_c02f007fc5b0452c")
 
x vTITEL push_back ("PAW_PBEXe_sv_GW17Apr2014")
 
x species_pp_version push_back ("Xe_sv_GW:PAW_PBE:17Apr2014")
 
x species_pp_AUID push_back ("133c9ead41c747b4")
 
x species_pp_groundstate_structure push_back ("N/A_133c9ead41c747b4")
 
x vEATOM push_back (9008.2142)
 
x species_pp_AUID push_back ("a2a66bbb705fd114")
 
x vEATOM push_back (572.3552)
 
x vTITEL push_back ("PAW_PBEYb_308Jul2013")
 
x species_pp push_back ("Yb_3")
 
x species_pp_version push_back ("Yb_3:PAW_PBE:08Jul2013")
 
x species_pp_AUID push_back ("d4d1484e34700879")
 
x vEATOM push_back (693.5759)
 
x vTITEL push_back ("PAW_PBEYb23Dec2003")
 
x species_pp_version push_back ("Yb:PAW_PBE:23Dec2003")
 
x species_pp_AUID push_back ("a73c5ae431db4485")
 
x species_pp_groundstate_structure push_back ("N/A_a73c5ae431db4485")
 
x vTITEL push_back ("PAW_PBEY_sv_GW05Dec2013")
 
x species_pp_version push_back ("Y_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("3189f0e60a077125")
 
x vTITEL push_back ("PAW_PBEY_sv25May2007")
 
x species_pp_version push_back ("Y_sv:PAW_PBE:25May2007")
 
x species_pp_AUID push_back ("2fb876577258940d")
 
x vTITEL push_back ("PAW_PBEZn_GW09Oct2010")
 
x species_pp_version push_back ("Zn_GW:PAW_PBE:09Oct2010")
 
x species_pp_AUID push_back ("c9d470aabc061907")
 
x vEATOM push_back (1748.8345)
 
x species_pp_AUID push_back ("7ed9d78dd30715fd")
 
x vTITEL push_back ("PAW_PBEZn_sv_GW05Dec2013")
 
x species_pp_version push_back ("Zn_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("53d23506232b67ac")
 
x vTITEL push_back ("PAW_PBEZr_sv_GW05Dec2013")
 
x species_pp_version push_back ("Zr_sv_GW:PAW_PBE:05Dec2013")
 
x species_pp_AUID push_back ("4b771ea128970dd1")
 
x vEATOM push_back (1282.4732)
 
x vTITEL push_back ("PAW_PBEZr_sv04Jan2005")
 
x species_pp_version push_back ("Zr_sv:PAW_PBE:04Jan2005")
 
x species_pp_AUID push_back ("a3ef4a907c7b4c96")
 

Variables

filename ="/common/VASP/pot_LDA/potcar.Apr00/Ag/POTCAR"
 
AUID ="639bb9917452d998"
 

Function Documentation

◆ push_back() [1/4950]

x vTITEL push_back ( "USAg"  )

◆ push_back() [2/4950]

x species push_back ( "Ag"  )

◆ push_back() [3/4950]

x species_Z push_back ( 47  )

◆ push_back() [4/4950]

x species_pp_type push_back ( "LDA"  )

◆ push_back() [5/4950]

x species_pp_version push_back ( "Ag:LDA:01Apr2000"  )

◆ push_back() [6/4950]

x species_pp_AUID push_back ( "639bb9917452d998"  )

◆ push_back() [7/4950]

x species_pp_groundstate_energy push_back ( -3.  744496)

◆ push_back() [8/4950]

x species_pp_groundstate_structure push_back ( "A1"  )

◆ push_back() [9/4950]

x vEATOM push_back ( 1281.  8324)

◆ push_back() [10/4950]

x vRMAX push_back ( 3.  431)

◆ push_back() [11/4950]

x vLEXCH push_back ( "CA"  )

◆ push_back() [12/4950]

vxpseudopotential push_back ( )

◆ push_back() [13/4950]

x vTITEL push_back ( "USAl"  )

◆ push_back() [14/4950]

x species push_back ( "Al"  )

◆ push_back() [15/4950]

x species_Z push_back ( 13  )

◆ push_back() [16/4950]

x species_pp_version push_back ( "Al:LDA:01Apr2000"  )

◆ push_back() [17/4950]

x species_pp_AUID push_back ( "ec638285f61e73c3"  )

◆ push_back() [18/4950]

x species_pp_groundstate_energy push_back ( -4.  231)

◆ push_back() [19/4950]

x vEATOM push_back ( 68.  9393)

◆ push_back() [20/4950]

x vRMAX push_back ( 1.  85)

◆ push_back() [21/4950]

x species_pp_AUID push_back ( "624cbf44af81780c"  )

◆ push_back() [22/4950]

x vEATOM push_back ( 4.  056)

◆ push_back() [23/4950]

x vTITEL push_back ( "USAr"  )

◆ push_back() [24/4950]

x species_pp push_back ( "Ar"  )

◆ push_back() [25/4950]

x species_Z push_back ( 18  )

◆ push_back() [26/4950]

x species_pp_version push_back ( "Ar:LDA:01Apr2000"  )

◆ push_back() [27/4950]

x species_pp_AUID push_back ( "d02666913ee8c984"  )

◆ push_back() [28/4950]

x species_pp_groundstate_energy push_back ( 123456)

◆ push_back() [29/4950]

x species_pp_groundstate_structure push_back ( "N/A_d02666913ee8c984"  )

◆ push_back() [30/4950]

x vEATOM push_back ( 624.  2154)

◆ push_back() [31/4950]

x vRMAX push_back ( 2.  65)

◆ push_back() [32/4950]

x vTITEL push_back ( "USAs"  )

◆ push_back() [33/4950]

x species push_back ( "As"  )

◆ push_back() [34/4950]

x species_Z push_back ( 33  )

◆ push_back() [35/4950]

x species_pp_version push_back ( "As:LDA:01Apr2000"  )

◆ push_back() [36/4950]

x species_pp_AUID push_back ( "6175700952b14721"  )

◆ push_back() [37/4950]

x species_pp_groundstate_structure push_back ( "N/A_6175700952b14721"  )

◆ push_back() [38/4950]

x vEATOM push_back ( 230.  9698)

◆ push_back() [39/4950]

x vTITEL push_back ( "USAu"  )

◆ push_back() [40/4950]

x species push_back ( "Au"  )

◆ push_back() [41/4950]

x species_Z push_back ( 79  )

◆ push_back() [42/4950]

x species_pp_version push_back ( "Au:LDA:01Apr2000"  )

◆ push_back() [43/4950]

x species_pp_AUID push_back ( "c42e6bdfe7e7024e"  )

◆ push_back() [44/4950]

x vEATOM push_back ( 1353.  1269)

◆ push_back() [45/4950]

x vTITEL push_back ( "USBa"  )

◆ push_back() [46/4950]

x species push_back ( "Ba"  )

◆ push_back() [47/4950]

x species_Z push_back ( 56  )

◆ push_back() [48/4950]

x species_pp_version push_back ( "Ba:LDA:01Apr2000"  )

◆ push_back() [49/4950]

x species_pp_AUID push_back ( "b5d1dafcf2f8d798"  )

◆ push_back() [50/4950]

x species_pp_groundstate_energy push_back ( -2.  19536)

◆ push_back() [51/4950]

x species_pp_groundstate_structure push_back ( "A2"  )

◆ push_back() [52/4950]

x vEATOM push_back ( 538.  619)

◆ push_back() [53/4950]

x vTITEL push_back ( "USBe"  )

◆ push_back() [54/4950]

x species push_back ( "Be"  )

◆ push_back() [55/4950]

x species_Z push_back ( )

◆ push_back() [56/4950]

x species_pp_version push_back ( "Be:LDA:01Apr2000"  )

◆ push_back() [57/4950]

x species_pp_AUID push_back ( "653b8d1063d6b4e0"  )

◆ push_back() [58/4950]

x species_pp_groundstate_structure push_back ( "A3"  )

◆ push_back() [59/4950]

x vEATOM push_back ( 33.  5025)

◆ push_back() [60/4950]

x vTITEL push_back ( "USBi"  )

◆ push_back() [61/4950]

x species push_back ( "Bi"  )

◆ push_back() [62/4950]

x species_Z push_back ( 83  )

◆ push_back() [63/4950]

x species_pp_version push_back ( "Bi:LDA:01Apr2000"  )

◆ push_back() [64/4950]

x species_pp_AUID push_back ( "7706078a4f3b44bd"  )

◆ push_back() [65/4950]

x species_pp_groundstate_structure push_back ( "N/A_7706078a4f3b44bd"  )

◆ push_back() [66/4950]

x vEATOM push_back ( 1944.  5848)

◆ push_back() [67/4950]

x species_pp_AUID push_back ( "8758bd99a53975ab"  )

◆ push_back() [68/4950]

x species_pp_groundstate_structure push_back ( "N/A_8758bd99a53975ab"  )

◆ push_back() [69/4950]

x vEATOM push_back ( 356.  0823)

◆ push_back() [70/4950]

x vTITEL push_back ( "USB"  )

◆ push_back() [71/4950]

x species push_back ( "B"  )

◆ push_back() [72/4950]

x species_Z push_back ( )

◆ push_back() [73/4950]

x species_pp_version push_back ( "B:LDA:01Apr2000"  )

◆ push_back() [74/4950]

x species_pp_AUID push_back ( "d6331b10128d6537"  )

◆ push_back() [75/4950]

x species_pp_groundstate_structure push_back ( "N/A_d6331b10128d6537"  )

◆ push_back() [76/4950]

x vEATOM push_back ( 70.  1632)

◆ push_back() [77/4950]

x vTITEL push_back ( "USBr"  )

◆ push_back() [78/4950]

x species push_back ( "Br"  )

◆ push_back() [79/4950]

x species_Z push_back ( 35  )

◆ push_back() [80/4950]

x species_pp_version push_back ( "Br:LDA:01Apr2000"  )

◆ push_back() [81/4950]

x species_pp_AUID push_back ( "43fcb04cd5b45940"  )

◆ push_back() [82/4950]

x species_pp_groundstate_structure push_back ( "N/A_43fcb04cd5b45940"  )

◆ push_back() [83/4950]

x vEATOM push_back ( 411.  3699)

◆ push_back() [84/4950]

x vTITEL push_back ( "USB_s"  )

◆ push_back() [85/4950]

x species_pp push_back ( "B_s"  )

◆ push_back() [86/4950]

x species_pp_version push_back ( "B_s:LDA:01Apr2000"  )

◆ push_back() [87/4950]

x species_pp_AUID push_back ( "691e76d3ce19f274"  )

◆ push_back() [88/4950]

x species_pp_groundstate_structure push_back ( "N/A_691e76d3ce19f274"  )

◆ push_back() [89/4950]

x vTITEL push_back ( "USCa"  )

◆ push_back() [90/4950]

x species push_back ( "Ca"  )

◆ push_back() [91/4950]

x species_Z push_back ( 20  )

◆ push_back() [92/4950]

x species_pp_version push_back ( "Ca:LDA:01Apr2000"  )

◆ push_back() [93/4950]

x species_pp_AUID push_back ( "d85b55fde567529b"  )

◆ push_back() [94/4950]

x vEATOM push_back ( 195.  0664)

◆ push_back() [95/4950]

x species_pp_AUID push_back ( "e65bce3da30c5d46"  )

◆ push_back() [96/4950]

x vEATOM push_back ( 629.  2095)

◆ push_back() [97/4950]

x vTITEL push_back ( "USCd"  )

◆ push_back() [98/4950]

x species push_back ( "Cd"  )

◆ push_back() [99/4950]

x species_Z push_back ( 48  )

◆ push_back() [100/4950]

x species_pp_version push_back ( "Cd:LDA:01Apr2000"  )

◆ push_back() [101/4950]

x species_pp_AUID push_back ( "07875e5a0789cd01"  )

◆ push_back() [102/4950]

x species_pp_groundstate_energy push_back ( -1.  53073)

◆ push_back() [103/4950]

x vEATOM push_back ( 1499.  9103)

◆ push_back() [104/4950]

x vTITEL push_back ( "USCl"  )

◆ push_back() [105/4950]

x species_pp push_back ( "Cl"  )

◆ push_back() [106/4950]

x species_Z push_back ( 17  )

◆ push_back() [107/4950]

x species_pp_version push_back ( "Cl:LDA:01Apr2000"  )

◆ push_back() [108/4950]

x species_pp_AUID push_back ( "df6024f6ee021cf9"  )

◆ push_back() [109/4950]

x species_pp_groundstate_structure push_back ( "N/A_df6024f6ee021cf9"  )

◆ push_back() [110/4950]

x vEATOM push_back ( 413.  6826)

◆ push_back() [111/4950]

x vTITEL push_back ( "USCo"  )

◆ push_back() [112/4950]

x species push_back ( "Co"  )

◆ push_back() [113/4950]

x species_Z push_back ( 27  )

◆ push_back() [114/4950]

x species_pp_version push_back ( "Co:LDA:01Apr2000"  )

◆ push_back() [115/4950]

x species_pp_AUID push_back ( "41f6635e51e063f9"  )

◆ push_back() [116/4950]

x species_pp_groundstate_energy push_back ( -8.  1376)

◆ push_back() [117/4950]

x vEATOM push_back ( 984.  849)

◆ push_back() [118/4950]

x vTITEL push_back ( "USC"  )

◆ push_back() [119/4950]

x species push_back ( "C"  )

◆ push_back() [120/4950]

x species_Z push_back ( )

◆ push_back() [121/4950]

x species_pp_version push_back ( "C:LDA:01Apr2000"  )

◆ push_back() [122/4950]

x species_pp_AUID push_back ( "d951d3c4d963900a"  )

◆ push_back() [123/4950]

x species_pp_groundstate_energy push_back ( -10.  15636)

◆ push_back() [124/4950]

x species_pp_groundstate_structure push_back ( "A9"  )

◆ push_back() [125/4950]

x vEATOM push_back ( 145.  3474)

◆ push_back() [126/4950]

x vTITEL push_back ( "USCr"  )

◆ push_back() [127/4950]

x species push_back ( "Cr"  )

◆ push_back() [128/4950]

x species_Z push_back ( 24  )

◆ push_back() [129/4950]

x species_pp_version push_back ( "Cr:LDA:01Apr2000"  )

◆ push_back() [130/4950]

x species_pp_AUID push_back ( "7ab8ddc788e0ece9"  )

◆ push_back() [131/4950]

x vEATOM push_back ( 491.  3656)

◆ push_back() [132/4950]

x vTITEL push_back ( "USC_s"  )

◆ push_back() [133/4950]

x species_pp push_back ( "C_s"  )

◆ push_back() [134/4950]

x species_pp_version push_back ( "C_s:LDA:01Apr2000"  )

◆ push_back() [135/4950]

x species_pp_AUID push_back ( "73c35c1982ecc74b"  )

◆ push_back() [136/4950]

x vTITEL push_back ( "USCs"  )

◆ push_back() [137/4950]

x species push_back ( "Cs"  )

◆ push_back() [138/4950]

x species_Z push_back ( 55  )

◆ push_back() [139/4950]

x species_pp_version push_back ( "Cs:LDA:01Apr2000"  )

◆ push_back() [140/4950]

x species_pp_AUID push_back ( "d4564ab900b08de9"  )

◆ push_back() [141/4950]

x species_pp_groundstate_structure push_back ( "N/A_d4564ab900b08de9"  )

◆ push_back() [142/4950]

x vEATOM push_back ( 162.  4381)

◆ push_back() [143/4950]

x vEATOM push_back ( 6.  656)

◆ push_back() [144/4950]

x species_pp_AUID push_back ( "26ec55c896795e1d"  )

◆ push_back() [145/4950]

x species_pp_groundstate_structure push_back ( "N/A_26ec55c896795e1d"  )

◆ push_back() [146/4950]

x vEATOM push_back ( 370.  071)

◆ push_back() [147/4950]

x vTITEL push_back ( "USCu"  )

◆ push_back() [148/4950]

x species push_back ( "Cu"  )

◆ push_back() [149/4950]

x species_Z push_back ( 29  )

◆ push_back() [150/4950]

x species_pp_version push_back ( "Cu:LDA:01Apr2000"  )

◆ push_back() [151/4950]

x species_pp_AUID push_back ( "88d5d10238695c60"  )

◆ push_back() [152/4950]

x vEATOM push_back ( 1420.  4336)

◆ push_back() [153/4950]

x vTITEL push_back ( "USFe"  )

◆ push_back() [154/4950]

x species push_back ( "Fe"  )

◆ push_back() [155/4950]

x species_Z push_back ( 26  )

◆ push_back() [156/4950]

x species_pp_version push_back ( "Fe:LDA:01Apr2000"  )

◆ push_back() [157/4950]

x species_pp_AUID push_back ( "53451df4122ca435"  )

◆ push_back() [158/4950]

x species_pp_groundstate_energy push_back ( -9.  27793)

◆ push_back() [159/4950]

x vEATOM push_back ( 796.  5147)

◆ push_back() [160/4950]

x vTITEL push_back ( "USF"  )

◆ push_back() [161/4950]

x species push_back ( "F"  )

◆ push_back() [162/4950]

x species_Z push_back ( )

◆ push_back() [163/4950]

x species_pp_version push_back ( "F:LDA:01Apr2000"  )

◆ push_back() [164/4950]

x species_pp_AUID push_back ( "7d78af3ddadedc15"  )

◆ push_back() [165/4950]

x species_pp_groundstate_structure push_back ( "N/A_7d78af3ddadedc15"  )

◆ push_back() [166/4950]

x vEATOM push_back ( 651.  277)

◆ push_back() [167/4950]

x vTITEL push_back ( "USF_s"  )

◆ push_back() [168/4950]

x species_pp push_back ( "F_s"  )

◆ push_back() [169/4950]

x species_pp_version push_back ( "F_s:LDA:01Apr2000"  )

◆ push_back() [170/4950]

x species_pp_AUID push_back ( "f8e61fafbbc42286"  )

◆ push_back() [171/4950]

x species_pp_groundstate_structure push_back ( "N/A_f8e61fafbbc42286"  )

◆ push_back() [172/4950]

x vEATOM push_back ( 639.  4032)

◆ push_back() [173/4950]

x vTITEL push_back ( "USGa"  )

◆ push_back() [174/4950]

x species push_back ( "Ga"  )

◆ push_back() [175/4950]

x species_Z push_back ( 31  )

◆ push_back() [176/4950]

x species_pp_version push_back ( "Ga:LDA:01Apr2000"  )

◆ push_back() [177/4950]

x species_pp_AUID push_back ( "187da9e099fe4582"  )

◆ push_back() [178/4950]

x species_pp_groundstate_structure push_back ( "N/A_187da9e099fe4582"  )

◆ push_back() [179/4950]

x vEATOM push_back ( 1667.  3148)

◆ push_back() [180/4950]

x species_pp_AUID push_back ( "f27f7a21bebee0b6"  )

◆ push_back() [181/4950]

x species_pp_groundstate_structure push_back ( "N/A_f27f7a21bebee0b6"  )

◆ push_back() [182/4950]

x vEATOM push_back ( 144.  6316)

◆ push_back() [183/4950]

x vTITEL push_back ( "USGe"  )

◆ push_back() [184/4950]

x species push_back ( "Ge"  )

◆ push_back() [185/4950]

x species_Z push_back ( 32  )

◆ push_back() [186/4950]

x species_pp_version push_back ( "Ge:LDA:01Apr2000"  )

◆ push_back() [187/4950]

x species_pp_AUID push_back ( "60aa6eae51da5ce4"  )

◆ push_back() [188/4950]

x species_pp_groundstate_energy push_back ( -5.  19244)

◆ push_back() [189/4950]

x species_pp_groundstate_structure push_back ( "A4"  )

◆ push_back() [190/4950]

x vEATOM push_back ( 180.  9206)

◆ push_back() [191/4950]

x vTITEL push_back ( "USH"  )

◆ push_back() [192/4950]

x species push_back ( "H"  )

◆ push_back() [193/4950]

x species_Z push_back ( )

◆ push_back() [194/4950]

x species_pp_version push_back ( "H:LDA:01Apr2000"  )

◆ push_back() [195/4950]

x species_pp_AUID push_back ( "74edc4d2a9d2d570"  )

◆ push_back() [196/4950]

x species_pp_groundstate_structure push_back ( "N/A_74edc4d2a9d2d570"  )

◆ push_back() [197/4950]

x vEATOM push_back ( 21.  7477)

◆ push_back() [198/4950]

x species_Z push_back ( )

◆ push_back() [199/4950]

x species_pp_AUID push_back ( "4a4f3563702289f2"  )

◆ push_back() [200/4950]

x species_pp_groundstate_structure push_back ( "N/A_4a4f3563702289f2"  )

◆ push_back() [201/4950]

x vEATOM push_back ( 12.  1324)

◆ push_back() [202/4950]

x species_pp_AUID push_back ( "065cd13e9f13c85d"  )

◆ push_back() [203/4950]

x species_pp_groundstate_structure push_back ( "N/A_065cd13e9f13c85d"  )

◆ push_back() [204/4950]

x vEATOM push_back ( 5.  823)

◆ push_back() [205/4950]

x vTITEL push_back ( "USHf"  )

◆ push_back() [206/4950]

x species push_back ( "Hf"  )

◆ push_back() [207/4950]

x species_Z push_back ( 72  )

◆ push_back() [208/4950]

x species_pp_version push_back ( "Hf:LDA:01Apr2000"  )

◆ push_back() [209/4950]

x species_pp_AUID push_back ( "1af9281ed7be5121"  )

◆ push_back() [210/4950]

x vEATOM push_back ( 202.  1673)

◆ push_back() [211/4950]

x vTITEL push_back ( "USHg"  )

◆ push_back() [212/4950]

x species push_back ( "Hg"  )

◆ push_back() [213/4950]

x species_Z push_back ( 80  )

◆ push_back() [214/4950]

x species_pp_version push_back ( "Hg:LDA:01Apr2000"  )

◆ push_back() [215/4950]

x species_pp_AUID push_back ( "03e3289690e1f860"  )

◆ push_back() [216/4950]

x species_pp_groundstate_energy push_back ( -0.  958689)

◆ push_back() [217/4950]

x species_pp_groundstate_structure push_back ( "A10(A3)"  )

◆ push_back() [218/4950]

x vEATOM push_back ( 1579.  3905)

◆ push_back() [219/4950]

x species_pp_AUID push_back ( "ac1f3cd0d6a33316"  )

◆ push_back() [220/4950]

x species_pp_groundstate_structure push_back ( "N/A_ac1f3cd0d6a33316"  )

◆ push_back() [221/4950]

x vTITEL push_back ( "USIn"  )

◆ push_back() [222/4950]

x species push_back ( "In"  )

◆ push_back() [223/4950]

x species_Z push_back ( 49  )

◆ push_back() [224/4950]

x species_pp_version push_back ( "In:LDA:01Apr2000"  )

◆ push_back() [225/4950]

x species_pp_AUID push_back ( "561944a648769209"  )

◆ push_back() [226/4950]

x species_pp_groundstate_structure push_back ( "N/A_561944a648769209"  )

◆ push_back() [227/4950]

x vEATOM push_back ( 1462.  7799)

◆ push_back() [228/4950]

x species_pp_AUID push_back ( "38bb66b66c502beb"  )

◆ push_back() [229/4950]

x species_pp_groundstate_structure push_back ( "N/A_38bb66b66c502beb"  )

◆ push_back() [230/4950]

x vEATOM push_back ( 193.  287)

◆ push_back() [231/4950]

x vTITEL push_back ( "USI"  )

◆ push_back() [232/4950]

x species push_back ( "I"  )

◆ push_back() [233/4950]

x species_Z push_back ( 53  )

◆ push_back() [234/4950]

x species_pp_version push_back ( "I:LDA:01Apr2000"  )

◆ push_back() [235/4950]

x species_pp_AUID push_back ( "338de127dfa56c08"  )

◆ push_back() [236/4950]

x species_pp_groundstate_structure push_back ( "N/A_338de127dfa56c08"  )

◆ push_back() [237/4950]

x vEATOM push_back ( 434.  8256)

◆ push_back() [238/4950]

x vTITEL push_back ( "USIr"  )

◆ push_back() [239/4950]

x species push_back ( "Ir"  )

◆ push_back() [240/4950]

x species_Z push_back ( 77  )

◆ push_back() [241/4950]

x species_pp_version push_back ( "Ir:LDA:01Apr2000"  )

◆ push_back() [242/4950]

x species_pp_AUID push_back ( "0d6f43382108d13d"  )

◆ push_back() [243/4950]

x vEATOM push_back ( 919.  6515)

◆ push_back() [244/4950]

x vTITEL push_back ( "USK"  )

◆ push_back() [245/4950]

x species push_back ( "K"  )

◆ push_back() [246/4950]

x species_Z push_back ( 19  )

◆ push_back() [247/4950]

x species_pp_version push_back ( "K:LDA:01Apr2000"  )

◆ push_back() [248/4950]

x species_pp_AUID push_back ( "bc9d6fb83de4a3e6"  )

◆ push_back() [249/4950]

x vEATOM push_back ( 152.  2493)

◆ push_back() [250/4950]

x species_pp_AUID push_back ( "828b9d8df4c3212b"  )

◆ push_back() [251/4950]

x vEATOM push_back ( 474.  4308)

◆ push_back() [252/4950]

x vTITEL push_back ( "USKr"  )

◆ push_back() [253/4950]

x species_pp push_back ( "Kr"  )

◆ push_back() [254/4950]

x species_Z push_back ( 36  )

◆ push_back() [255/4950]

x species_pp_version push_back ( "Kr:LDA:01Apr2000"  )

◆ push_back() [256/4950]

x species_pp_AUID push_back ( "af69c2573427c4dc"  )

◆ push_back() [257/4950]

x species_pp_groundstate_structure push_back ( "N/A_af69c2573427c4dc"  )

◆ push_back() [258/4950]

x vEATOM push_back ( 536.  4416)

◆ push_back() [259/4950]

x species_pp_AUID push_back ( "df36a4e58e2ce8a3"  )

◆ push_back() [260/4950]

x species_pp_groundstate_structure push_back ( "N/A_df36a4e58e2ce8a3"  )

◆ push_back() [261/4950]

x vEATOM push_back ( 14.  417)

◆ push_back() [262/4950]

x vEATOM push_back ( 7.  685)

◆ push_back() [263/4950]

x vTITEL push_back ( "USLi"  )

◆ push_back() [264/4950]

x species push_back ( "Li"  )

◆ push_back() [265/4950]

x species_pp_version push_back ( "Li:LDA:01Apr2000"  )

◆ push_back() [266/4950]

x species_pp_AUID push_back ( "1c81ce7af52fff4e"  )

◆ push_back() [267/4950]

x species_pp_groundstate_structure push_back ( "A2*"  )

◆ push_back() [268/4950]

x species_pp_AUID push_back ( "bea66b246b1c188f"  )

◆ push_back() [269/4950]

x species_pp_groundstate_structure push_back ( "N/A_bea66b246b1c188f"  )

◆ push_back() [270/4950]

x vTITEL push_back ( "USMg"  )

◆ push_back() [271/4950]

x species push_back ( "Mg"  )

◆ push_back() [272/4950]

x species_Z push_back ( 12  )

◆ push_back() [273/4950]

x species_pp_version push_back ( "Mg:LDA:01Apr2000"  )

◆ push_back() [274/4950]

x species_pp_AUID push_back ( "78efd19d72d98cb8"  )

◆ push_back() [275/4950]

x vEATOM push_back ( 41.  1333)

◆ push_back() [276/4950]

x species_pp_AUID push_back ( "61fec4224ab4cab8"  )

◆ push_back() [277/4950]

x species_pp_AUID push_back ( "1308594682e50447"  )

◆ push_back() [278/4950]

x vEATOM push_back ( 925.  6982)

◆ push_back() [279/4950]

x vTITEL push_back ( "USMn"  )

◆ push_back() [280/4950]

x species push_back ( "Mn"  )

◆ push_back() [281/4950]

x species_Z push_back ( 25  )

◆ push_back() [282/4950]

x species_pp_version push_back ( "Mn:LDA:01Apr2000"  )

◆ push_back() [283/4950]

x species_pp_AUID push_back ( "86604354cd00dea2"  )

◆ push_back() [284/4950]

x species_pp_groundstate_structure push_back ( "N/A_86604354cd00dea2"  )

◆ push_back() [285/4950]

x vEATOM push_back ( 630.  4458)

◆ push_back() [286/4950]

x species_pp_AUID push_back ( "9cb565e70151b871"  )

◆ push_back() [287/4950]

x species_pp_groundstate_structure push_back ( "N/A_9cb565e70151b871"  )

◆ push_back() [288/4950]

x vEATOM push_back ( 1917.  7914)

◆ push_back() [289/4950]

x vTITEL push_back ( "USMo"  )

◆ push_back() [290/4950]

x species push_back ( "Mo"  )

◆ push_back() [291/4950]

x species_Z push_back ( 42  )

◆ push_back() [292/4950]

x species_pp_version push_back ( "Mo:LDA:01Apr2000"  )

◆ push_back() [293/4950]

x species_pp_AUID push_back ( "c56388dcfe8555c0"  )

◆ push_back() [294/4950]

x species_pp_groundstate_energy push_back ( -12.  1515)

◆ push_back() [295/4950]

x species_pp_AUID push_back ( "097174f08d663402"  )

◆ push_back() [296/4950]

x species_pp_groundstate_energy push_back ( -11.  7663)

◆ push_back() [297/4950]

x vEATOM push_back ( 1363.  5863)

◆ push_back() [298/4950]

x vTITEL push_back ( "NCNa"  )

◆ push_back() [299/4950]

x species push_back ( "Na"  )

◆ push_back() [300/4950]

x species_Z push_back ( 11  )

◆ push_back() [301/4950]

x species_pp_version push_back ( "Na:LDA:01Apr2000"  )

◆ push_back() [302/4950]

x species_pp_AUID push_back ( "d7694c246a0273a3"  )

◆ push_back() [303/4950]

x species_pp_groundstate_structure push_back ( "N/A_d7694c246a0273a3"  )

◆ push_back() [304/4950]

x vTITEL push_back ( "USNa"  )

◆ push_back() [305/4950]

x species_pp_AUID push_back ( "dd66cbd5fb6f15d9"  )

◆ push_back() [306/4950]

x species_pp_groundstate_structure push_back ( "N/A_dd66cbd5fb6f15d9"  )

◆ push_back() [307/4950]

x species_pp_AUID push_back ( "09046b7179097410"  )

◆ push_back() [308/4950]

x species_pp_groundstate_structure push_back ( "N/A_09046b7179097410"  )

◆ push_back() [309/4950]

x vEATOM push_back ( 721.  3)

◆ push_back() [310/4950]

x vTITEL push_back ( "USNb"  )

◆ push_back() [311/4950]

x species push_back ( "Nb"  )

◆ push_back() [312/4950]

x species_Z push_back ( 41  )

◆ push_back() [313/4950]

x species_pp_version push_back ( "Nb:LDA:01Apr2000"  )

◆ push_back() [314/4950]

x species_pp_AUID push_back ( "31fbbfcce7b1cf49"  )

◆ push_back() [315/4950]

x vEATOM push_back ( 343.  5564)

◆ push_back() [316/4950]

x species_pp_AUID push_back ( "31ac6525497e7fb5"  )

◆ push_back() [317/4950]

x vEATOM push_back ( 1123.  9911)

◆ push_back() [318/4950]

x vTITEL push_back ( "USNe"  )

◆ push_back() [319/4950]

x species push_back ( "Ne"  )

◆ push_back() [320/4950]

x species_Z push_back ( 10  )

◆ push_back() [321/4950]

x species_pp_version push_back ( "Ne:LDA:01Apr2000"  )

◆ push_back() [322/4950]

x species_pp_AUID push_back ( "4bda2c3e931df0db"  )

◆ push_back() [323/4950]

x vEATOM push_back ( 927.  2544)

◆ push_back() [324/4950]

x vTITEL push_back ( "USNi"  )

◆ push_back() [325/4950]

x species push_back ( "Ni"  )

◆ push_back() [326/4950]

x species_Z push_back ( 28  )

◆ push_back() [327/4950]

x species_pp_version push_back ( "Ni:LDA:01Apr2000"  )

◆ push_back() [328/4950]

x species_pp_AUID push_back ( "134ab84006e2f008"  )

◆ push_back() [329/4950]

x species_pp_groundstate_energy push_back ( -6.  586101)

◆ push_back() [330/4950]

x vEATOM push_back ( 1197.  3512)

◆ push_back() [331/4950]

x vTITEL push_back ( "USN"  )

◆ push_back() [332/4950]

x species push_back ( "N"  )

◆ push_back() [333/4950]

x species_Z push_back ( )

◆ push_back() [334/4950]

x species_pp_version push_back ( "N:LDA:01Apr2000"  )

◆ push_back() [335/4950]

x species_pp_AUID push_back ( "276e909660f3ef22"  )

◆ push_back() [336/4950]

x species_pp_groundstate_structure push_back ( "N/A_276e909660f3ef22"  )

◆ push_back() [337/4950]

x vEATOM push_back ( 261.  5416)

◆ push_back() [338/4950]

x vTITEL push_back ( "USN_s"  )

◆ push_back() [339/4950]

x species_pp push_back ( "N_s"  )

◆ push_back() [340/4950]

x species_pp_version push_back ( "N_s:LDA:01Apr2000"  )

◆ push_back() [341/4950]

x species_pp_AUID push_back ( "afe2ea3dc40fcbdb"  )

◆ push_back() [342/4950]

x species_pp_groundstate_structure push_back ( "N/A_afe2ea3dc40fcbdb"  )

◆ push_back() [343/4950]

x vEATOM push_back ( 260.  0508)

◆ push_back() [344/4950]

x vTITEL push_back ( "USO"  )

◆ push_back() [345/4950]

x species push_back ( "O"  )

◆ push_back() [346/4950]

x species_Z push_back ( )

◆ push_back() [347/4950]

x species_pp_version push_back ( "O:LDA:01Apr2000"  )

◆ push_back() [348/4950]

x species_pp_AUID push_back ( "8e95e1160f67e677"  )

◆ push_back() [349/4950]

x species_pp_groundstate_structure push_back ( "N/A_8e95e1160f67e677"  )

◆ push_back() [350/4950]

x vEATOM push_back ( 427.  4741)

◆ push_back() [351/4950]

x vTITEL push_back ( "USO_s"  )

◆ push_back() [352/4950]

x species_pp push_back ( "O_s"  )

◆ push_back() [353/4950]

x species_pp_version push_back ( "O_s:LDA:01Apr2000"  )

◆ push_back() [354/4950]

x species_pp_AUID push_back ( "52427dc57b32a100"  )

◆ push_back() [355/4950]

x species_pp_groundstate_structure push_back ( "N/A_52427dc57b32a100"  )

◆ push_back() [356/4950]

x vEATOM push_back ( 423.  4034)

◆ push_back() [357/4950]

x vTITEL push_back ( "USOs"  )

◆ push_back() [358/4950]

x species push_back ( "Os"  )

◆ push_back() [359/4950]

x species_Z push_back ( 76  )

◆ push_back() [360/4950]

x species_pp_version push_back ( "Os:LDA:01Apr2000"  )

◆ push_back() [361/4950]

x species_pp_AUID push_back ( "8c0f432aa073c44a"  )

◆ push_back() [362/4950]

x vEATOM push_back ( 732.  8093)

◆ push_back() [363/4950]

x vTITEL push_back ( "USPb_d"  )

◆ push_back() [364/4950]

x species push_back ( "Pb"  )

◆ push_back() [365/4950]

x species_Z push_back ( 82  )

◆ push_back() [366/4950]

x species_pp push_back ( "Pb_d"  )

◆ push_back() [367/4950]

x species_pp_version push_back ( "Pb_d:LDA:01Apr2000"  )

◆ push_back() [368/4950]

x species_pp_AUID push_back ( "58341640c6c638ed"  )

◆ push_back() [369/4950]

x vEATOM push_back ( 1932.  2852)

◆ push_back() [370/4950]

x vTITEL push_back ( "USPb"  )

◆ push_back() [371/4950]

x species_pp_version push_back ( "Pb:LDA:01Apr2000"  )

◆ push_back() [372/4950]

x species_pp_AUID push_back ( "626de6bdde387007"  )

◆ push_back() [373/4950]

x vEATOM push_back ( 270.  2479)

◆ push_back() [374/4950]

x vTITEL push_back ( "USPd"  )

◆ push_back() [375/4950]

x species push_back ( "Pd"  )

◆ push_back() [376/4950]

x species_Z push_back ( 46  )

◆ push_back() [377/4950]

x species_pp_version push_back ( "Pd:LDA:01Apr2000"  )

◆ push_back() [378/4950]

x species_pp_AUID push_back ( "552d7d192268351d"  )

◆ push_back() [379/4950]

x vEATOM push_back ( 1063.  0176)

◆ push_back() [380/4950]

x vTITEL push_back ( "USP"  )

◆ push_back() [381/4950]

x species_pp push_back ( "P"  )

◆ push_back() [382/4950]

x species_Z push_back ( 15  )

◆ push_back() [383/4950]

x species_pp_version push_back ( "P:LDA:01Apr2000"  )

◆ push_back() [384/4950]

x species_pp_AUID push_back ( "6e885c4fb160579c"  )

◆ push_back() [385/4950]

x species_pp_groundstate_structure push_back ( "N/A_6e885c4fb160579c"  )

◆ push_back() [386/4950]

x vEATOM push_back ( 185.  9163)

◆ push_back() [387/4950]

x vTITEL push_back ( "USPt"  )

◆ push_back() [388/4950]

x species push_back ( "Pt"  )

◆ push_back() [389/4950]

x species_Z push_back ( 78  )

◆ push_back() [390/4950]

x species_pp_version push_back ( "Pt:LDA:01Apr2000"  )

◆ push_back() [391/4950]

x species_pp_AUID push_back ( "129e32c460592b3d"  )

◆ push_back() [392/4950]

x species_pp_groundstate_energy push_back ( -7.  42489)

◆ push_back() [393/4950]

x vEATOM push_back ( 1129.  7465)

◆ push_back() [394/4950]

x vTITEL push_back ( "USRb"  )

◆ push_back() [395/4950]

x species push_back ( "Rb"  )

◆ push_back() [396/4950]

x species_Z push_back ( 37  )

◆ push_back() [397/4950]

x species_pp_version push_back ( "Rb:LDA:01Apr2000"  )

◆ push_back() [398/4950]

x species_pp_AUID push_back ( "40bc918883f81068"  )

◆ push_back() [399/4950]

x species_pp_groundstate_structure push_back ( "N/A_40bc918883f81068"  )

◆ push_back() [400/4950]

x vEATOM push_back ( 159.  4732)

◆ push_back() [401/4950]

x species_pp_AUID push_back ( "375397ff589aa867"  )

◆ push_back() [402/4950]

x species_pp_groundstate_structure push_back ( "N/A_375397ff589aa867"  )

◆ push_back() [403/4950]

x vEATOM push_back ( 417.  3018)

◆ push_back() [404/4950]

x species_pp_AUID push_back ( "a614e02bf7a3817f"  )

◆ push_back() [405/4950]

x species_pp_groundstate_structure push_back ( "N/A_a614e02bf7a3817f"  )

◆ push_back() [406/4950]

x vEATOM push_back ( 15.  3793)

◆ push_back() [407/4950]

x vEATOM push_back ( 8.  159)

◆ push_back() [408/4950]

x vTITEL push_back ( "USRe"  )

◆ push_back() [409/4950]

x species push_back ( "Re"  )

◆ push_back() [410/4950]

x species_Z push_back ( 75  )

◆ push_back() [411/4950]

x species_pp_version push_back ( "Re:LDA:01Apr2000"  )

◆ push_back() [412/4950]

x species_pp_AUID push_back ( "98510e8bfa14709e"  )

◆ push_back() [413/4950]

x species_pp_groundstate_energy push_back ( -13.  77736)

◆ push_back() [414/4950]

x vEATOM push_back ( 567.  4411)

◆ push_back() [415/4950]

x vTITEL push_back ( "USRh"  )

◆ push_back() [416/4950]

x species push_back ( "Rh"  )

◆ push_back() [417/4950]

x species_Z push_back ( 45  )

◆ push_back() [418/4950]

x species_pp_version push_back ( "Rh:LDA:01Apr2000"  )

◆ push_back() [419/4950]

x species_pp_AUID push_back ( "883dfe9dc76b6f31"  )

◆ push_back() [420/4950]

x vEATOM push_back ( 861.  179)

◆ push_back() [421/4950]

x vTITEL push_back ( "USRu"  )

◆ push_back() [422/4950]

x species push_back ( "Ru"  )

◆ push_back() [423/4950]

x species_Z push_back ( 44  )

◆ push_back() [424/4950]

x species_pp_version push_back ( "Ru:LDA:01Apr2000"  )

◆ push_back() [425/4950]

x species_pp_AUID push_back ( "d45ec3c5462bef36"  )

◆ push_back() [426/4950]

x vEATOM push_back ( 690.  4189)

◆ push_back() [427/4950]

x vTITEL push_back ( "USSb"  )

◆ push_back() [428/4950]

x species push_back ( "Sb"  )

◆ push_back() [429/4950]

x species_Z push_back ( 51  )

◆ push_back() [430/4950]

x species_pp_version push_back ( "Sb:LDA:01Apr2000"  )

◆ push_back() [431/4950]

x species_pp_AUID push_back ( "af09be12c107a564"  )

◆ push_back() [432/4950]

x species_pp_groundstate_structure push_back ( "N/A_af09be12c107a564"  )

◆ push_back() [433/4950]

x vEATOM push_back ( 286.  5443)

◆ push_back() [434/4950]

x vTITEL push_back ( "USSc"  )

◆ push_back() [435/4950]

x species push_back ( "Sc"  )

◆ push_back() [436/4950]

x species_Z push_back ( 21  )

◆ push_back() [437/4950]

x species_pp_version push_back ( "Sc:LDA:01Apr2000"  )

◆ push_back() [438/4950]

x species_pp_AUID push_back ( "4e27e0eebb4ca9ea"  )

◆ push_back() [439/4950]

x vEATOM push_back ( 234.  0213)

◆ push_back() [440/4950]

x species_pp_AUID push_back ( "5b645c3a2198a968"  )

◆ push_back() [441/4950]

x vEATOM push_back ( 821.  8432)

◆ push_back() [442/4950]

x vTITEL push_back ( "USSe"  )

◆ push_back() [443/4950]

x species push_back ( "Se"  )

◆ push_back() [444/4950]

x species_Z push_back ( 34  )

◆ push_back() [445/4950]

x species_pp_version push_back ( "Se:LDA:01Apr2000"  )

◆ push_back() [446/4950]

x species_pp_AUID push_back ( "0cb582a5e39b8c55"  )

◆ push_back() [447/4950]

x species_pp_groundstate_structure push_back ( "N/A_0cb582a5e39b8c55"  )

◆ push_back() [448/4950]

x vEATOM push_back ( 310.  1866)

◆ push_back() [449/4950]

x vTITEL push_back ( "USSi"  )

◆ push_back() [450/4950]

x species push_back ( "Si"  )

◆ push_back() [451/4950]

x species_Z push_back ( 14  )

◆ push_back() [452/4950]

x species_pp_version push_back ( "Si:LDA:01Apr2000"  )

◆ push_back() [453/4950]

x species_pp_AUID push_back ( "530c405087cb5e2b"  )

◆ push_back() [454/4950]

x vEATOM push_back ( 115.  7938)

◆ push_back() [455/4950]

x species_pp_AUID push_back ( "6b54cf2aa9fd187c"  )

◆ push_back() [456/4950]

x vTITEL push_back ( "USSn_d"  )

◆ push_back() [457/4950]

x species push_back ( "Sn"  )

◆ push_back() [458/4950]

x species_Z push_back ( 50  )

◆ push_back() [459/4950]

x species_pp push_back ( "Sn_d"  )

◆ push_back() [460/4950]

x species_pp_version push_back ( "Sn_d:LDA:01Apr2000"  )

◆ push_back() [461/4950]

x species_pp_AUID push_back ( "a2e329add3479de3"  )

◆ push_back() [462/4950]

x species_pp_groundstate_structure push_back ( "N/A_a2e329add3479de3"  )

◆ push_back() [463/4950]

x vEATOM push_back ( 2027.  8371)

◆ push_back() [464/4950]

x vTITEL push_back ( "USSn"  )

◆ push_back() [465/4950]

x species_pp_version push_back ( "Sn:LDA:01Apr2000"  )

◆ push_back() [466/4950]

x species_pp_AUID push_back ( "ca6469d06b413059"  )

◆ push_back() [467/4950]

x species_pp_groundstate_structure push_back ( "N/A_ca6469d06b413059"  )

◆ push_back() [468/4950]

x vEATOM push_back ( 258.  2269)

◆ push_back() [469/4950]

x vTITEL push_back ( "USS"  )

◆ push_back() [470/4950]

x species_pp push_back ( "S"  )

◆ push_back() [471/4950]

x species_Z push_back ( 16  )

◆ push_back() [472/4950]

x species_pp_version push_back ( "S:LDA:01Apr2000"  )

◆ push_back() [473/4950]

x species_pp_AUID push_back ( "f9662cbc7d0fabaf"  )

◆ push_back() [474/4950]

x species_pp_groundstate_structure push_back ( "N/A_f9662cbc7d0fabaf"  )

◆ push_back() [475/4950]

x vEATOM push_back ( 283.  6887)

◆ push_back() [476/4950]

x vTITEL push_back ( "USSr"  )

◆ push_back() [477/4950]

x species push_back ( "Sr"  )

◆ push_back() [478/4950]

x species_Z push_back ( 38  )

◆ push_back() [479/4950]

x species_pp_version push_back ( "Sr:LDA:01Apr2000"  )

◆ push_back() [480/4950]

x species_pp_AUID push_back ( "6fb0d22509f8b232"  )

◆ push_back() [481/4950]

x species_pp_AUID push_back ( "b3f00f0671094a1c"  )

◆ push_back() [482/4950]

x vEATOM push_back ( 543.  8576)

◆ push_back() [483/4950]

x vTITEL push_back ( "USTc"  )

◆ push_back() [484/4950]

x species push_back ( "Tc"  )

◆ push_back() [485/4950]

x species_Z push_back ( 43  )

◆ push_back() [486/4950]

x species_pp_version push_back ( "Tc:LDA:01Apr2000"  )

◆ push_back() [487/4950]

x species_pp_AUID push_back ( "34c9772cc010d2cb"  )

◆ push_back() [488/4950]

x vEATOM push_back ( 549.  171)

◆ push_back() [489/4950]

x vTITEL push_back ( "USTe"  )

◆ push_back() [490/4950]

x species push_back ( "Te"  )

◆ push_back() [491/4950]

x species_Z push_back ( 52  )

◆ push_back() [492/4950]

x species_pp_version push_back ( "Te:LDA:01Apr2000"  )

◆ push_back() [493/4950]

x species_pp_AUID push_back ( "40e90a399e2b7edd"  )

◆ push_back() [494/4950]

x species_pp_groundstate_structure push_back ( "N/A_40e90a399e2b7edd"  )

◆ push_back() [495/4950]

x vEATOM push_back ( 350.  5223)

◆ push_back() [496/4950]

x vTITEL push_back ( "USTi"  )

◆ push_back() [497/4950]

x species push_back ( "Ti"  )

◆ push_back() [498/4950]

x species_Z push_back ( 22  )

◆ push_back() [499/4950]

x species_pp_version push_back ( "Ti:LDA:01Apr2000"  )

◆ push_back() [500/4950]

x species_pp_AUID push_back ( "e97d34c6b4cd62df"  )

◆ push_back() [501/4950]

x vEATOM push_back ( 294.  6956)

◆ push_back() [502/4950]

x species_pp_AUID push_back ( "8e962327621a06f8"  )

◆ push_back() [503/4950]

x vEATOM push_back ( 1051.  1593)

◆ push_back() [504/4950]

x vTITEL push_back ( "USTl_d"  )

◆ push_back() [505/4950]

x species push_back ( "Tl"  )

◆ push_back() [506/4950]

x species_Z push_back ( 81  )

◆ push_back() [507/4950]

x species_pp push_back ( "Tl_d"  )

◆ push_back() [508/4950]

x species_pp_version push_back ( "Tl_d:LDA:01Apr2000"  )

◆ push_back() [509/4950]

x species_pp_AUID push_back ( "06fbb1e6c3452edb"  )

◆ push_back() [510/4950]

x vEATOM push_back ( 1355.  4676)

◆ push_back() [511/4950]

x vTITEL push_back ( "USV"  )

◆ push_back() [512/4950]

x species push_back ( "V"  )

◆ push_back() [513/4950]

x species_Z push_back ( 23  )

◆ push_back() [514/4950]

x species_pp_version push_back ( "V:LDA:01Apr2000"  )

◆ push_back() [515/4950]

x species_pp_AUID push_back ( "40048762e7327671"  )

◆ push_back() [516/4950]

x vEATOM push_back ( 378.  1565)

◆ push_back() [517/4950]

x species_pp_AUID push_back ( "ea4e243d3a0747f9"  )

◆ push_back() [518/4950]

x vEATOM push_back ( 1319.  1534)

◆ push_back() [519/4950]

x vTITEL push_back ( "USW"  )

◆ push_back() [520/4950]

x species push_back ( "W"  )

◆ push_back() [521/4950]

x species_Z push_back ( 74  )

◆ push_back() [522/4950]

x species_pp_version push_back ( "W:LDA:01Apr2000"  )

◆ push_back() [523/4950]

x species_pp_AUID push_back ( "c895658f3e6606f4"  )

◆ push_back() [524/4950]

x species_pp_groundstate_energy push_back ( -14.  1883)

◆ push_back() [525/4950]

x vEATOM push_back ( 425.  9531)

◆ push_back() [526/4950]

x vTITEL push_back ( "USXe"  )

◆ push_back() [527/4950]

x species push_back ( "Xe"  )

◆ push_back() [528/4950]

x species_Z push_back ( 54  )

◆ push_back() [529/4950]

x species_pp_version push_back ( "Xe:LDA:01Apr2000"  )

◆ push_back() [530/4950]

x species_pp_AUID push_back ( "f264028d17d7b729"  )

◆ push_back() [531/4950]

x species_pp_groundstate_structure push_back ( "N/A_f264028d17d7b729"  )

◆ push_back() [532/4950]

x vEATOM push_back ( 520.  8311)

◆ push_back() [533/4950]

x vTITEL push_back ( "USY"  )

◆ push_back() [534/4950]

x species push_back ( "Y"  )

◆ push_back() [535/4950]

x species_Z push_back ( 39  )

◆ push_back() [536/4950]

x species_pp_version push_back ( "Y:LDA:01Apr2000"  )

◆ push_back() [537/4950]

x species_pp_AUID push_back ( "18ed87089235423b"  )

◆ push_back() [538/4950]

x vEATOM push_back ( 224.  2364)

◆ push_back() [539/4950]

x species_pp_AUID push_back ( "5c8efcbfc77486c0"  )

◆ push_back() [540/4950]

x vEATOM push_back ( 714.  9408)

◆ push_back() [541/4950]

x vTITEL push_back ( "USZn"  )

◆ push_back() [542/4950]

x species push_back ( "Zn"  )

◆ push_back() [543/4950]

x species_Z push_back ( 30  )

◆ push_back() [544/4950]

x species_pp_version push_back ( "Zn:LDA:01Apr2000"  )

◆ push_back() [545/4950]

x species_pp_AUID push_back ( "d321d33f5619ef83"  )

◆ push_back() [546/4950]

x vEATOM push_back ( 1489.  2)

◆ push_back() [547/4950]

x vTITEL push_back ( "USZr"  )

◆ push_back() [548/4950]

x species push_back ( "Zr"  )

◆ push_back() [549/4950]

x species_Z push_back ( 40  )

◆ push_back() [550/4950]

x species_pp_version push_back ( "Zr:LDA:01Apr2000"  )

◆ push_back() [551/4950]

x species_pp_AUID push_back ( "c87b485bdb0c4683"  )

◆ push_back() [552/4950]

x vEATOM push_back ( 273.  846)

◆ push_back() [553/4950]

x species_pp_AUID push_back ( "3f478742b0dd98d0"  )

◆ push_back() [554/4950]

x vEATOM push_back ( 906.  2782)

◆ push_back() [555/4950]

x species_pp_type push_back ( "GGA"  )

◆ push_back() [556/4950]

x species_pp_version push_back ( "Ag:GGA:01Apr2000"  )

◆ push_back() [557/4950]

x species_pp_AUID push_back ( "dac6684dedca50c0"  )

◆ push_back() [558/4950]

x vEATOM push_back ( 1289.  4751)

◆ push_back() [559/4950]

x vLEXCH push_back ( "91"  )

◆ push_back() [560/4950]

x species_pp_version push_back ( "Al:GGA:01Apr2000"  )

◆ push_back() [561/4950]

x species_pp_AUID push_back ( "a0a3e933f8f5dcc7"  )

◆ push_back() [562/4950]

x vEATOM push_back ( 69.  1068)

◆ push_back() [563/4950]

x species_pp_AUID push_back ( "e7afb3f96db37614"  )

◆ push_back() [564/4950]

x species_pp_AUID push_back ( "7b8a659806e9f8e2"  )

◆ push_back() [565/4950]

x species_pp_groundstate_structure push_back ( "N/A_7b8a659806e9f8e2"  )

◆ push_back() [566/4950]

x vEATOM push_back ( 578.  6243)

◆ push_back() [567/4950]

x species_pp_version push_back ( "As:GGA:01Apr2000"  )

◆ push_back() [568/4950]

x species_pp_AUID push_back ( "836135d1f3fc1e24"  )

◆ push_back() [569/4950]

x species_pp_groundstate_structure push_back ( "N/A_836135d1f3fc1e24"  )

◆ push_back() [570/4950]

x vEATOM push_back ( 231.  282)

◆ push_back() [571/4950]

x species_pp_version push_back ( "Au:GGA:01Apr2000"  )

◆ push_back() [572/4950]

x species_pp_AUID push_back ( "fdbc4d4856dea2ca"  )

◆ push_back() [573/4950]

x vEATOM push_back ( 1360.  6319)

◆ push_back() [574/4950]

x species_pp_version push_back ( "Ba:GGA:01Apr2000"  )

◆ push_back() [575/4950]

x species_pp_AUID push_back ( "45efe879c954c89e"  )

◆ push_back() [576/4950]

x species_pp_version push_back ( "Be:GGA:01Apr2000"  )

◆ push_back() [577/4950]

x species_pp_AUID push_back ( "0134da61389a9f60"  )

◆ push_back() [578/4950]

x vEATOM push_back ( 34.  3531)

◆ push_back() [579/4950]

x species_pp_version push_back ( "Bi:GGA:01Apr2000"  )

◆ push_back() [580/4950]

x species_pp_AUID push_back ( "248dc8cba6dcb6a3"  )

◆ push_back() [581/4950]

x species_pp_groundstate_structure push_back ( "N/A_248dc8cba6dcb6a3"  )

◆ push_back() [582/4950]

x vEATOM push_back ( 358.  5989)

◆ push_back() [583/4950]

x species_pp_version push_back ( "B:GGA:01Apr2000"  )

◆ push_back() [584/4950]

x species_pp_AUID push_back ( "485b42706cceeccc"  )

◆ push_back() [585/4950]

x species_pp_groundstate_structure push_back ( "N/A_485b42706cceeccc"  )

◆ push_back() [586/4950]

x species_pp_version push_back ( "Br:GGA:01Apr2000"  )

◆ push_back() [587/4950]

x species_pp_AUID push_back ( "a49954c11d9d86b3"  )

◆ push_back() [588/4950]

x species_pp_groundstate_structure push_back ( "N/A_a49954c11d9d86b3"  )

◆ push_back() [589/4950]

x species_pp_version push_back ( "B_s:GGA:01Apr2000"  )

◆ push_back() [590/4950]

x species_pp_AUID push_back ( "adb44bb29e01385a"  )

◆ push_back() [591/4950]

x species_pp_groundstate_structure push_back ( "N/A_adb44bb29e01385a"  )

◆ push_back() [592/4950]

x species_pp_version push_back ( "Ca:GGA:01Apr2000"  )

◆ push_back() [593/4950]

x species_pp_AUID push_back ( "3e3d86ebf8f9e84a"  )

◆ push_back() [594/4950]

x vEATOM push_back ( 201.  4911)

◆ push_back() [595/4950]

x species_pp_AUID push_back ( "572c23d8cdb07c91"  )

◆ push_back() [596/4950]

x vEATOM push_back ( 642.  6706)

◆ push_back() [597/4950]

x species_pp_version push_back ( "Cd:GGA:01Apr2000"  )

◆ push_back() [598/4950]

x species_pp_AUID push_back ( "f0b4c3233e3b19d8"  )

◆ push_back() [599/4950]

x vEATOM push_back ( 1507.  8696)

◆ push_back() [600/4950]

x species_pp_version push_back ( "Cl:GGA:01Apr2000"  )

◆ push_back() [601/4950]

x species_pp_AUID push_back ( "3c433c53fdc11247"  )

◆ push_back() [602/4950]

x species_pp_groundstate_structure push_back ( "N/A_3c433c53fdc11247"  )

◆ push_back() [603/4950]

x vEATOM push_back ( 414.  14)

◆ push_back() [604/4950]

x species_pp_version push_back ( "Co:GGA:01Apr2000"  )

◆ push_back() [605/4950]

x species_pp_AUID push_back ( "4fb418aa1d0f1607"  )

◆ push_back() [606/4950]

x vEATOM push_back ( 992.  3421)

◆ push_back() [607/4950]

x species_pp_version push_back ( "C:GGA:01Apr2000"  )

◆ push_back() [608/4950]

x species_pp_AUID push_back ( "31c540de1efdd804"  )

◆ push_back() [609/4950]

x vEATOM push_back ( 146.  0548)

◆ push_back() [610/4950]

x species_pp_version push_back ( "Cr:GGA:01Apr2000"  )

◆ push_back() [611/4950]

x species_pp_AUID push_back ( "235696d86e852bef"  )

◆ push_back() [612/4950]

x vEATOM push_back ( 498.  0791)

◆ push_back() [613/4950]

x species_pp_version push_back ( "C_s:GGA:01Apr2000"  )

◆ push_back() [614/4950]

x species_pp_AUID push_back ( "3ff7c326f3a2d786"  )

◆ push_back() [615/4950]

x species_pp_version push_back ( "Cs:GGA:01Apr2000"  )

◆ push_back() [616/4950]

x species_pp_AUID push_back ( "e980274f4b6a500e"  )

◆ push_back() [617/4950]

x species_pp_groundstate_structure push_back ( "N/A_e980274f4b6a500e"  )

◆ push_back() [618/4950]

x vEATOM push_back ( 165.  1832)

◆ push_back() [619/4950]

x species_pp_AUID push_back ( "7f1c46a7520ac7ef"  )

◆ push_back() [620/4950]

x species_pp_groundstate_structure push_back ( "N/A_7f1c46a7520ac7ef"  )

◆ push_back() [621/4950]

x species_pp_version push_back ( "Cu:GGA:01Apr2000"  )

◆ push_back() [622/4950]

x species_pp_AUID push_back ( "82741f3fd74a85b4"  )

◆ push_back() [623/4950]

x vEATOM push_back ( 1426.  8255)

◆ push_back() [624/4950]

x species_pp_version push_back ( "Fe:GGA:01Apr2000"  )

◆ push_back() [625/4950]

x species_pp_AUID push_back ( "ca7f0085c55a7aa1"  )

◆ push_back() [626/4950]

x vEATOM push_back ( 803.  9917)

◆ push_back() [627/4950]

x species_pp_version push_back ( "F:GGA:01Apr2000"  )

◆ push_back() [628/4950]

x species_pp_AUID push_back ( "dde0140445688d51"  )

◆ push_back() [629/4950]

x species_pp_groundstate_structure push_back ( "N/A_dde0140445688d51"  )

◆ push_back() [630/4950]

x vEATOM push_back ( 653.  619)

◆ push_back() [631/4950]

x species_pp_version push_back ( "F_s:GGA:01Apr2000"  )

◆ push_back() [632/4950]

x species_pp_AUID push_back ( "34d991756a93140b"  )

◆ push_back() [633/4950]

x species_pp_groundstate_structure push_back ( "N/A_34d991756a93140b"  )

◆ push_back() [634/4950]

x vEATOM push_back ( 641.  7727)

◆ push_back() [635/4950]

x species_pp_version push_back ( "Ga:GGA:01Apr2000"  )

◆ push_back() [636/4950]

x species_pp_AUID push_back ( "5c72a53af32e0b5d"  )

◆ push_back() [637/4950]

x species_pp_groundstate_structure push_back ( "N/A_5c72a53af32e0b5d"  )

◆ push_back() [638/4950]

x vEATOM push_back ( 1665.  5353)

◆ push_back() [639/4950]

x species_pp_AUID push_back ( "bf167e402544fb63"  )

◆ push_back() [640/4950]

x species_pp_groundstate_structure push_back ( "N/A_bf167e402544fb63"  )

◆ push_back() [641/4950]

x species_pp_version push_back ( "Ge:GGA:01Apr2000"  )

◆ push_back() [642/4950]

x species_pp_AUID push_back ( "fd03d8c50dd891a8"  )

◆ push_back() [643/4950]

x vEATOM push_back ( 181.  7757)

◆ push_back() [644/4950]

x species_pp_version push_back ( "H:GGA:01Apr2000"  )

◆ push_back() [645/4950]

x species_pp_AUID push_back ( "f5011ad08efd2146"  )

◆ push_back() [646/4950]

x species_pp_groundstate_structure push_back ( "N/A_f5011ad08efd2146"  )

◆ push_back() [647/4950]

x species_pp_version push_back ( "Hf:GGA:01Apr2000"  )

◆ push_back() [648/4950]

x species_pp_AUID push_back ( "bb7552942568c756"  )

◆ push_back() [649/4950]

x vEATOM push_back ( 204.  7909)

◆ push_back() [650/4950]

x species_pp_version push_back ( "Hg:GGA:01Apr2000"  )

◆ push_back() [651/4950]

x species_pp_AUID push_back ( "bc158f9698c492b9"  )

◆ push_back() [652/4950]

x vEATOM push_back ( 1586.  8975)

◆ push_back() [653/4950]

x species_pp_AUID push_back ( "a63ed4003cfebbd7"  )

◆ push_back() [654/4950]

x species_pp_groundstate_structure push_back ( "N/A_a63ed4003cfebbd7"  )

◆ push_back() [655/4950]

x species_pp_version push_back ( "In:GGA:01Apr2000"  )

◆ push_back() [656/4950]

x species_pp_AUID push_back ( "ba5977510b0502b1"  )

◆ push_back() [657/4950]

x species_pp_groundstate_structure push_back ( "N/A_ba5977510b0502b1"  )

◆ push_back() [658/4950]

x species_pp_AUID push_back ( "e2f4044fe6dda094"  )

◆ push_back() [659/4950]

x species_pp_groundstate_structure push_back ( "N/A_e2f4044fe6dda094"  )

◆ push_back() [660/4950]

x vEATOM push_back ( 194.  9782)

◆ push_back() [661/4950]

x species_pp_version push_back ( "I:GGA:01Apr2000"  )

◆ push_back() [662/4950]

x species_pp_AUID push_back ( "bcea72f30350cc6b"  )

◆ push_back() [663/4950]

x species_pp_groundstate_structure push_back ( "N/A_bcea72f30350cc6b"  )

◆ push_back() [664/4950]

x species_pp_version push_back ( "Ir:GGA:01Apr2000"  )

◆ push_back() [665/4950]

x species_pp_AUID push_back ( "8714595dd67f5cc6"  )

◆ push_back() [666/4950]

x vEATOM push_back ( 926.  7563)

◆ push_back() [667/4950]

x species_pp_version push_back ( "K:GGA:01Apr2000"  )

◆ push_back() [668/4950]

x species_pp_AUID push_back ( "1faff02cfb784b29"  )

◆ push_back() [669/4950]

x vEATOM push_back ( 148.  7127)

◆ push_back() [670/4950]

x species_pp_AUID push_back ( "e9c22b07bc0ec1ed"  )

◆ push_back() [671/4950]

x vEATOM push_back ( 476.  4122)

◆ push_back() [672/4950]

x species_pp_version push_back ( "Li:GGA:01Apr2000"  )

◆ push_back() [673/4950]

x species_pp_AUID push_back ( "6076711c64467c4f"  )

◆ push_back() [674/4950]

x species_pp_AUID push_back ( "d4e05cd9779f8ffb"  )

◆ push_back() [675/4950]

x species_pp_groundstate_structure push_back ( "N/A_d4e05cd9779f8ffb"  )

◆ push_back() [676/4950]

x species_pp_version push_back ( "Mg:GGA:01Apr2000"  )

◆ push_back() [677/4950]

x species_pp_AUID push_back ( "d8bb30571ef22203"  )

◆ push_back() [678/4950]

x species_pp_AUID push_back ( "285c78eec2b06a80"  )

◆ push_back() [679/4950]

x species_pp_AUID push_back ( "7a5a79e9587d1be6"  )

◆ push_back() [680/4950]

x vEATOM push_back ( 941.  7867)

◆ push_back() [681/4950]

x species_pp_version push_back ( "Mn:GGA:01Apr2000"  )

◆ push_back() [682/4950]

x species_pp_AUID push_back ( "376fb5a708716dac"  )

◆ push_back() [683/4950]

x species_pp_groundstate_structure push_back ( "N/A_376fb5a708716dac"  )

◆ push_back() [684/4950]

x vEATOM push_back ( 637.  703)

◆ push_back() [685/4950]

x species_pp_version push_back ( "Mo:GGA:01Apr2000"  )

◆ push_back() [686/4950]

x species_pp_AUID push_back ( "8f74857b7edbc55b"  )

◆ push_back() [687/4950]

x vEATOM push_back ( 437.  1493)

◆ push_back() [688/4950]

x species_pp_AUID push_back ( "3e6c7aec9ade11fe"  )

◆ push_back() [689/4950]

x vEATOM push_back ( 1365.  1191)

◆ push_back() [690/4950]

x species_pp_version push_back ( "Na:GGA:01Apr2000"  )

◆ push_back() [691/4950]

x species_pp_AUID push_back ( "744ca88ef7759690"  )

◆ push_back() [692/4950]

x species_pp_groundstate_structure push_back ( "N/A_744ca88ef7759690"  )

◆ push_back() [693/4950]

x species_pp_AUID push_back ( "bbb7e42a76945cab"  )

◆ push_back() [694/4950]

x species_pp_groundstate_structure push_back ( "N/A_bbb7e42a76945cab"  )

◆ push_back() [695/4950]

x species_pp_AUID push_back ( "29d62af47013503e"  )

◆ push_back() [696/4950]

x species_pp_groundstate_structure push_back ( "N/A_29d62af47013503e"  )

◆ push_back() [697/4950]

x vEATOM push_back ( 750.  3777)

◆ push_back() [698/4950]

x species_pp_version push_back ( "Nb:GGA:01Apr2000"  )

◆ push_back() [699/4950]

x species_pp_AUID push_back ( "724f3dcc974f7f25"  )

◆ push_back() [700/4950]

x vEATOM push_back ( 346.  0595)

◆ push_back() [701/4950]

x species_pp_AUID push_back ( "e1ae346e0f041fdc"  )

◆ push_back() [702/4950]

x vEATOM push_back ( 1125.  2619)

◆ push_back() [703/4950]

x species_pp_AUID push_back ( "78bf25649465a255"  )

◆ push_back() [704/4950]

x vEATOM push_back ( 935.  9586)

◆ push_back() [705/4950]

x species_pp_version push_back ( "Ni:GGA:01Apr2000"  )

◆ push_back() [706/4950]

x species_pp_AUID push_back ( "eafb70a88aeb4012"  )

◆ push_back() [707/4950]

x vEATOM push_back ( 1204.  5406)

◆ push_back() [708/4950]

x species_pp_version push_back ( "N:GGA:01Apr2000"  )

◆ push_back() [709/4950]

x species_pp_AUID push_back ( "2a63672b627f782f"  )

◆ push_back() [710/4950]

x species_pp_groundstate_structure push_back ( "N/A_2a63672b627f782f"  )

◆ push_back() [711/4950]

x vEATOM push_back ( 262.  6548)

◆ push_back() [712/4950]

x species_pp_version push_back ( "N_s:GGA:01Apr2000"  )

◆ push_back() [713/4950]

x species_pp_AUID push_back ( "c043353c5d80ce7b"  )

◆ push_back() [714/4950]

x species_pp_groundstate_structure push_back ( "N/A_c043353c5d80ce7b"  )

◆ push_back() [715/4950]

x species_pp_version push_back ( "O:GGA:01Apr2000"  )

◆ push_back() [716/4950]

x species_pp_AUID push_back ( "dfc84c75903b64f2"  )

◆ push_back() [717/4950]

x species_pp_groundstate_structure push_back ( "N/A_dfc84c75903b64f2"  )

◆ push_back() [718/4950]

x vEATOM push_back ( 429.  1268)

◆ push_back() [719/4950]

x species_pp_version push_back ( "O_s:GGA:01Apr2000"  )

◆ push_back() [720/4950]

x species_pp_AUID push_back ( "e36222ea6f81db33"  )

◆ push_back() [721/4950]

x species_pp_groundstate_structure push_back ( "N/A_e36222ea6f81db33"  )

◆ push_back() [722/4950]

x species_pp_version push_back ( "Os:GGA:01Apr2000"  )

◆ push_back() [723/4950]

x species_pp_AUID push_back ( "458230748f9ee8c4"  )

◆ push_back() [724/4950]

x vEATOM push_back ( 739.  3468)

◆ push_back() [725/4950]

x species_pp_version push_back ( "Pb_d:GGA:01Apr2000"  )

◆ push_back() [726/4950]

x species_pp_AUID push_back ( "1c02af03a0cb18b2"  )

◆ push_back() [727/4950]

x vEATOM push_back ( 1939.  2932)

◆ push_back() [728/4950]

x species_pp_version push_back ( "Pb:GGA:01Apr2000"  )

◆ push_back() [729/4950]

x species_pp_AUID push_back ( "899670f2ebab4069"  )

◆ push_back() [730/4950]

x vEATOM push_back ( 272.  5339)

◆ push_back() [731/4950]

x species_pp_version push_back ( "Pd:GGA:01Apr2000"  )

◆ push_back() [732/4950]

x species_pp_AUID push_back ( "854a0d2f9191bbb2"  )

◆ push_back() [733/4950]

x vEATOM push_back ( 1069.  3437)

◆ push_back() [734/4950]

x species_pp_version push_back ( "P:GGA:01Apr2000"  )

◆ push_back() [735/4950]

x species_pp_AUID push_back ( "6f60f1f4a221fc11"  )

◆ push_back() [736/4950]

x species_pp_groundstate_structure push_back ( "N/A_6f60f1f4a221fc11"  )

◆ push_back() [737/4950]

x vEATOM push_back ( 186.  0002)

◆ push_back() [738/4950]

x species_pp_version push_back ( "Pt:GGA:01Apr2000"  )

◆ push_back() [739/4950]

x species_pp_AUID push_back ( "4934ee186867e17b"  )

◆ push_back() [740/4950]

x vEATOM push_back ( 1137.  168)

◆ push_back() [741/4950]

x species_pp_version push_back ( "Rb:GGA:01Apr2000"  )

◆ push_back() [742/4950]

x species_pp_AUID push_back ( "a61aecaa4f3c1451"  )

◆ push_back() [743/4950]

x species_pp_groundstate_structure push_back ( "N/A_a61aecaa4f3c1451"  )

◆ push_back() [744/4950]

x vEATOM push_back ( 56.  2889)

◆ push_back() [745/4950]

x species_pp_AUID push_back ( "06ce9bbf35bcc17a"  )

◆ push_back() [746/4950]

x species_pp_groundstate_structure push_back ( "N/A_06ce9bbf35bcc17a"  )

◆ push_back() [747/4950]

x vEATOM push_back ( 418.  2566)

◆ push_back() [748/4950]

x species_pp_version push_back ( "Re:GGA:01Apr2000"  )

◆ push_back() [749/4950]

x species_pp_AUID push_back ( "7c2099bc993d23a3"  )

◆ push_back() [750/4950]

x vEATOM push_back ( 573.  1852)

◆ push_back() [751/4950]

x species_pp_version push_back ( "Rh:GGA:01Apr2000"  )

◆ push_back() [752/4950]

x species_pp_AUID push_back ( "b02edafce0da47bc"  )

◆ push_back() [753/4950]

x vEATOM push_back ( 866.  1095)

◆ push_back() [754/4950]

x species_pp_version push_back ( "Ru:GGA:01Apr2000"  )

◆ push_back() [755/4950]

x species_pp_AUID push_back ( "1fa7a7266ef21653"  )

◆ push_back() [756/4950]

x vEATOM push_back ( 694.  4264)

◆ push_back() [757/4950]

x species_pp_version push_back ( "Sb:GGA:01Apr2000"  )

◆ push_back() [758/4950]

x species_pp_AUID push_back ( "685a8003a0544919"  )

◆ push_back() [759/4950]

x species_pp_groundstate_structure push_back ( "N/A_685a8003a0544919"  )

◆ push_back() [760/4950]

x vEATOM push_back ( 287.  3334)

◆ push_back() [761/4950]

x species_pp_version push_back ( "Sc:GGA:01Apr2000"  )

◆ push_back() [762/4950]

x species_pp_AUID push_back ( "11f9d8ee4231562f"  )

◆ push_back() [763/4950]

x vEATOM push_back ( 240.  0055)

◆ push_back() [764/4950]

x species_pp_AUID push_back ( "90cbeb0ff7fd69f7"  )

◆ push_back() [765/4950]

x vEATOM push_back ( 824.  5618)

◆ push_back() [766/4950]

x species_pp_version push_back ( "Se:GGA:01Apr2000"  )

◆ push_back() [767/4950]

x species_pp_AUID push_back ( "3ff15ef5a76ace31"  )

◆ push_back() [768/4950]

x species_pp_groundstate_structure push_back ( "N/A_3ff15ef5a76ace31"  )

◆ push_back() [769/4950]

x species_pp_version push_back ( "Si:GGA:01Apr2000"  )

◆ push_back() [770/4950]

x species_pp_AUID push_back ( "69684f2b4007eeda"  )

◆ push_back() [771/4950]

x species_pp_AUID push_back ( "b19b07eb7ec794be"  )

◆ push_back() [772/4950]

x species_pp_version push_back ( "Sn_d:GGA:01Apr2000"  )

◆ push_back() [773/4950]

x species_pp_AUID push_back ( "6a74e8ec7cdff583"  )

◆ push_back() [774/4950]

x species_pp_groundstate_structure push_back ( "N/A_6a74e8ec7cdff583"  )

◆ push_back() [775/4950]

x vEATOM push_back ( 2035.  7006)

◆ push_back() [776/4950]

x species_pp_version push_back ( "Sn:GGA:01Apr2000"  )

◆ push_back() [777/4950]

x species_pp_AUID push_back ( "70e23373b95459e4"  )

◆ push_back() [778/4950]

x species_pp_groundstate_structure push_back ( "A5"  )

◆ push_back() [779/4950]

x species_pp_version push_back ( "S:GGA:01Apr2000"  )

◆ push_back() [780/4950]

x species_pp_AUID push_back ( "650b4d5a8eed9d9c"  )

◆ push_back() [781/4950]

x species_pp_groundstate_structure push_back ( "N/A_650b4d5a8eed9d9c"  )

◆ push_back() [782/4950]

x species_pp_version push_back ( "Sr:GGA:01Apr2000"  )

◆ push_back() [783/4950]

x species_pp_AUID push_back ( "82ec420862ed9432"  )

◆ push_back() [784/4950]

x vEATOM push_back ( 198.  3777)

◆ push_back() [785/4950]

x species_pp_AUID push_back ( "24554a4dcb7ec11b"  )

◆ push_back() [786/4950]

x vEATOM push_back ( 545.  413)

◆ push_back() [787/4950]

x vTITEL push_back ( "USTa"  )

◆ push_back() [788/4950]

x species push_back ( "Ta"  )

◆ push_back() [789/4950]

x species_Z push_back ( 73  )

◆ push_back() [790/4950]

x species_pp_version push_back ( "Ta:GGA:01Apr2000"  )

◆ push_back() [791/4950]

x species_pp_AUID push_back ( "ecb6cb1d273c3dcf"  )

◆ push_back() [792/4950]

x vEATOM push_back ( 303.  8835)

◆ push_back() [793/4950]

x species_pp_version push_back ( "Tc:GGA:01Apr2000"  )

◆ push_back() [794/4950]

x species_pp_AUID push_back ( "fd329b53fcbb5dbd"  )

◆ push_back() [795/4950]

x vEATOM push_back ( 552.  528)

◆ push_back() [796/4950]

x species_pp_version push_back ( "Te:GGA:01Apr2000"  )

◆ push_back() [797/4950]

x species_pp_AUID push_back ( "9ae592164e7ffdb9"  )

◆ push_back() [798/4950]

x species_pp_groundstate_structure push_back ( "N/A_9ae592164e7ffdb9"  )

◆ push_back() [799/4950]

x species_pp_version push_back ( "Ti:GGA:01Apr2000"  )

◆ push_back() [800/4950]

x species_pp_AUID push_back ( "8498e164009c60f7"  )

◆ push_back() [801/4950]

x vEATOM push_back ( 300.  793)

◆ push_back() [802/4950]

x species_pp_AUID push_back ( "257a6b2b7e91023a"  )

◆ push_back() [803/4950]

x vEATOM push_back ( 1054.  1422)

◆ push_back() [804/4950]

x species_pp_version push_back ( "Tl_d:GGA:01Apr2000"  )

◆ push_back() [805/4950]

x species_pp_AUID push_back ( "9f2d6c60104e71a3"  )

◆ push_back() [806/4950]

x species_pp_version push_back ( "V:GGA:01Apr2000"  )

◆ push_back() [807/4950]

x species_pp_AUID push_back ( "aee485cb636ab31d"  )

◆ push_back() [808/4950]

x vEATOM push_back ( 384.  374)

◆ push_back() [809/4950]

x species_pp_AUID push_back ( "d16570ec1e90da05"  )

◆ push_back() [810/4950]

x vEATOM push_back ( 1322.  2422)

◆ push_back() [811/4950]

x species_pp_version push_back ( "W:GGA:01Apr2000"  )

◆ push_back() [812/4950]

x species_pp_AUID push_back ( "fc6e347dc7ddd7ab"  )

◆ push_back() [813/4950]

x vEATOM push_back ( 430.  7818)

◆ push_back() [814/4950]

x species_pp_version push_back ( "Y:GGA:01Apr2000"  )

◆ push_back() [815/4950]

x species_pp_AUID push_back ( "a0835c00b2263c8b"  )

◆ push_back() [816/4950]

x vEATOM push_back ( 227.  3216)

◆ push_back() [817/4950]

x species_pp_AUID push_back ( "377b8f487d291e0e"  )

◆ push_back() [818/4950]

x vEATOM push_back ( 716.  1656)

◆ push_back() [819/4950]

x species_pp_version push_back ( "Zn:GGA:01Apr2000"  )

◆ push_back() [820/4950]

x species_pp_AUID push_back ( "c765a5877b95887a"  )

◆ push_back() [821/4950]

x species_pp_version push_back ( "Zr:GGA:01Apr2000"  )

◆ push_back() [822/4950]

x species_pp_AUID push_back ( "a2c98479cda145dd"  )

◆ push_back() [823/4950]

x vEATOM push_back ( 276.  4055)

◆ push_back() [824/4950]

x species_pp_AUID push_back ( "ae40f9ef1519f7f7"  )

◆ push_back() [825/4950]

x vEATOM push_back ( 907.  3869)

◆ push_back() [826/4950]

x vTITEL push_back ( "PAWAc12Apr2000"  )

◆ push_back() [827/4950]

x species_pp push_back ( "Ac"  )

◆ push_back() [828/4950]

x species_Z push_back ( 89  )

◆ push_back() [829/4950]

x species_pp_type push_back ( "PAW_LDA"  )

◆ push_back() [830/4950]

x species_pp_version push_back ( "Ac:PAW_LDA:12Apr2000"  )

◆ push_back() [831/4950]

x species_pp_AUID push_back ( "f4d16e5d594ed3ef"  )

◆ push_back() [832/4950]

x vEATOM push_back ( 816.  8257)

◆ push_back() [833/4950]

x vTITEL push_back ( "PAWAc_s12Apr2000"  )

◆ push_back() [834/4950]

x species_pp push_back ( "Ac_s"  )

◆ push_back() [835/4950]

x species_pp_version push_back ( "Ac_s:PAW_LDA:12Apr2000"  )

◆ push_back() [836/4950]

x species_pp_AUID push_back ( "863169f4af8ed89f"  )

◆ push_back() [837/4950]

x vEATOM push_back ( 504.  0082)

◆ push_back() [838/4950]

x vTITEL push_back ( "PAWAg17Apr2000"  )

◆ push_back() [839/4950]

x species_pp_version push_back ( "Ag:PAW_LDA:17Apr2000"  )

◆ push_back() [840/4950]

x species_pp_AUID push_back ( "9144029176631616"  )

◆ push_back() [841/4950]

x vEATOM push_back ( 1039.  7256)

◆ push_back() [842/4950]

x vTITEL push_back ( "PAW_GGAAl_h08Apr2002"  )

◆ push_back() [843/4950]

x species_pp push_back ( "Al_h"  )

◆ push_back() [844/4950]

x species_pp_type push_back ( "PAW_GGA"  )

◆ push_back() [845/4950]

x species_pp_version push_back ( "Al_h:PAW_GGA:08Apr2002"  )

◆ push_back() [846/4950]

x species_pp_AUID push_back ( "b9cdcfa63ddf1ea9"  )

◆ push_back() [847/4950]

x vEATOM push_back ( 53.  793)

◆ push_back() [848/4950]

x vTITEL push_back ( "PAWAl17Apr2000"  )

◆ push_back() [849/4950]

x species_pp_version push_back ( "Al:PAW_LDA:17Apr2000"  )

◆ push_back() [850/4950]

x species_pp_AUID push_back ( "2b253cb3349b4835"  )

◆ push_back() [851/4950]

x vTITEL push_back ( "PAWAr07Sep2000"  )

◆ push_back() [852/4950]

x species_pp_version push_back ( "Ar:PAW_LDA:07Sep2000"  )

◆ push_back() [853/4950]

x species_pp_AUID push_back ( "5ea4f89868f4ce2e"  )

◆ push_back() [854/4950]

x vEATOM push_back ( 579.  6582)

◆ push_back() [855/4950]

x vTITEL push_back ( "PAWAs03Mar1998"  )

◆ push_back() [856/4950]

x species_pp_version push_back ( "As:PAW_LDA:03Mar1998"  )

◆ push_back() [857/4950]

x species_pp_AUID push_back ( "a47a2fd0edb95060"  )

◆ push_back() [858/4950]

x species_pp_groundstate_structure push_back ( "N/A_a47a2fd0edb95060"  )

◆ push_back() [859/4950]

x vEATOM push_back ( 171.  6739)

◆ push_back() [860/4950]

x vTITEL push_back ( "PAWAu04Feb1998"  )

◆ push_back() [861/4950]

x species_pp_version push_back ( "Au:PAW_LDA:04Feb1998"  )

◆ push_back() [862/4950]

x species_pp_AUID push_back ( "834bf85c5ba24d77"  )

◆ push_back() [863/4950]

x vEATOM push_back ( 929.  4667)

◆ push_back() [864/4950]

x vTITEL push_back ( "PAWBa_sv17Apr2000"  )

◆ push_back() [865/4950]

x species_pp push_back ( "Ba_sv"  )

◆ push_back() [866/4950]

x species_pp_version push_back ( "Ba_sv:PAW_LDA:17Apr2000"  )

◆ push_back() [867/4950]

x species_pp_AUID push_back ( "7cbe610c465db194"  )

◆ push_back() [868/4950]

x vEATOM push_back ( 704.  0172)

◆ push_back() [869/4950]

x vTITEL push_back ( "PAWBe02Feb1998"  )

◆ push_back() [870/4950]

x species_pp_version push_back ( "Be:PAW_LDA:02Feb1998"  )

◆ push_back() [871/4950]

x species_pp_AUID push_back ( "d89972c63683236a"  )

◆ push_back() [872/4950]

x vEATOM push_back ( 27.  3297)

◆ push_back() [873/4950]

x vTITEL push_back ( "PAWBe_sv23Feb1998"  )

◆ push_back() [874/4950]

x species_pp push_back ( "Be_sv"  )

◆ push_back() [875/4950]

x species_pp_version push_back ( "Be_sv:PAW_LDA:23Feb1998"  )

◆ push_back() [876/4950]

x species_pp_AUID push_back ( "abd9038ab359fe8e"  )

◆ push_back() [877/4950]

x vEATOM push_back ( 393.  1076)

◆ push_back() [878/4950]

x vTITEL push_back ( "PAWB_h17Apr2000"  )

◆ push_back() [879/4950]

x species_pp push_back ( "B_h"  )

◆ push_back() [880/4950]

x species_pp_version push_back ( "B_h:PAW_LDA:17Apr2000"  )

◆ push_back() [881/4950]

x species_pp_AUID push_back ( "70110ee6c6cbaf90"  )

◆ push_back() [882/4950]

x species_pp_groundstate_structure push_back ( "ICSD_56992"  )

◆ push_back() [883/4950]

x vTITEL push_back ( "PAWBi_d09Feb1998"  )

◆ push_back() [884/4950]

x species_pp push_back ( "Bi_d"  )

◆ push_back() [885/4950]

x species_pp_version push_back ( "Bi_d:PAW_LDA:09Feb1998"  )

◆ push_back() [886/4950]

x species_pp_AUID push_back ( "e7de488226a41e64"  )

◆ push_back() [887/4950]

x species_pp_groundstate_structure push_back ( "N/A_e7de488226a41e64"  )

◆ push_back() [888/4950]

x vEATOM push_back ( 1963.  8324)

◆ push_back() [889/4950]

x vTITEL push_back ( "PAWBi03Oct2001"  )

◆ push_back() [890/4950]

x species_pp_version push_back ( "Bi:PAW_LDA:03Oct2001"  )

◆ push_back() [891/4950]

x species_pp_AUID push_back ( "9feb9d7bb7920ed5"  )

◆ push_back() [892/4950]

x species_pp_groundstate_structure push_back ( "N/A_9feb9d7bb7920ed5"  )

◆ push_back() [893/4950]

x vTITEL push_back ( "PAWB16Feb1998"  )

◆ push_back() [894/4950]

x species_pp_version push_back ( "B:PAW_LDA:16Feb1998"  )

◆ push_back() [895/4950]

x species_pp_AUID push_back ( "84d8f4621caed09d"  )

◆ push_back() [896/4950]

x species_pp_groundstate_structure push_back ( "N/A_84d8f4621caed09d"  )

◆ push_back() [897/4950]

x vTITEL push_back ( "PAWBr03Mar1998"  )

◆ push_back() [898/4950]

x species_pp_version push_back ( "Br:PAW_LDA:03Mar1998"  )

◆ push_back() [899/4950]

x species_pp_AUID push_back ( "0256a1be4ec8b5d9"  )

◆ push_back() [900/4950]

x species_pp_groundstate_structure push_back ( "N/A_0256a1be4ec8b5d9"  )

◆ push_back() [901/4950]

x vTITEL push_back ( "PAWB_s21Dec2000"  )

◆ push_back() [902/4950]

x species_pp_version push_back ( "B_s:PAW_LDA:21Dec2000"  )

◆ push_back() [903/4950]

x species_pp_AUID push_back ( "e099e30d73da7e2d"  )

◆ push_back() [904/4950]

x species_pp_groundstate_structure push_back ( "N/A_e099e30d73da7e2d"  )

◆ push_back() [905/4950]

x vTITEL push_back ( "PAWCa_pv05May1998"  )

◆ push_back() [906/4950]

x species_pp push_back ( "Ca_pv"  )

◆ push_back() [907/4950]

x species_pp_version push_back ( "Ca_pv:PAW_LDA:05May1998"  )

◆ push_back() [908/4950]

x species_pp_AUID push_back ( "26e7ac00e1d3cd41"  )

◆ push_back() [909/4950]

x vEATOM push_back ( 613.  8843)

◆ push_back() [910/4950]

x vTITEL push_back ( "PAWCa_sv17Apr2000"  )

◆ push_back() [911/4950]

x species_pp push_back ( "Ca_sv"  )

◆ push_back() [912/4950]

x species_pp_version push_back ( "Ca_sv:PAW_LDA:17Apr2000"  )

◆ push_back() [913/4950]

x species_pp_AUID push_back ( "3bdd926d04dbca1e"  )

◆ push_back() [914/4950]

x vEATOM push_back ( 1006.  6708)

◆ push_back() [915/4950]

x vTITEL push_back ( "PAWCd03Mar1998"  )

◆ push_back() [916/4950]

x species_pp_version push_back ( "Cd:PAW_LDA:03Mar1998"  )

◆ push_back() [917/4950]

x species_pp_AUID push_back ( "c5c179cf112468e6"  )

◆ push_back() [918/4950]

x vEATOM push_back ( 1296.  0499)

◆ push_back() [919/4950]

x vTITEL push_back ( "PAWCe28Sep2000"  )

◆ push_back() [920/4950]

x species_pp push_back ( "Ce"  )

◆ push_back() [921/4950]

x species_Z push_back ( 58  )

◆ push_back() [922/4950]

x species_pp_version push_back ( "Ce:PAW_LDA:28Sep2000"  )

◆ push_back() [923/4950]

x species_pp_AUID push_back ( "43bef7da77f3563c"  )

◆ push_back() [924/4950]

x vEATOM push_back ( 1067.  1067)

◆ push_back() [925/4950]

x vTITEL push_back ( "PAWCe_s17Apr2000"  )

◆ push_back() [926/4950]

x species_pp push_back ( "Ce_s"  )

◆ push_back() [927/4950]

x species_pp_version push_back ( "Ce_s:PAW_LDA:17Apr2000"  )

◆ push_back() [928/4950]

x species_pp_AUID push_back ( "27449258606dd200"  )

◆ push_back() [929/4950]

x vEATOM push_back ( 700.  2239)

◆ push_back() [930/4950]

x vTITEL push_back ( "PAWC_h17Apr2000"  )

◆ push_back() [931/4950]

x species_pp push_back ( "C_h"  )

◆ push_back() [932/4950]

x species_pp_version push_back ( "C_h:PAW_LDA:17Apr2000"  )

◆ push_back() [933/4950]

x species_pp_AUID push_back ( "00d46f7c41fd745f"  )

◆ push_back() [934/4950]

x vTITEL push_back ( "PAWCl_h21Jan2003"  )

◆ push_back() [935/4950]

x species_pp push_back ( "Cl_h"  )

◆ push_back() [936/4950]

x species_pp_version push_back ( "Cl_h:PAW_LDA:21Jan2003"  )

◆ push_back() [937/4950]

x species_pp_AUID push_back ( "508318a7f7ed2e81"  )

◆ push_back() [938/4950]

x species_pp_groundstate_structure push_back ( "N/A_508318a7f7ed2e81"  )

◆ push_back() [939/4950]

x vEATOM push_back ( 410.  3267)

◆ push_back() [940/4950]

x vTITEL push_back ( "PAWCl21Jan2003"  )

◆ push_back() [941/4950]

x species_pp_version push_back ( "Cl:PAW_LDA:21Jan2003"  )

◆ push_back() [942/4950]

x species_pp_AUID push_back ( "3bb9944485caf6e7"  )

◆ push_back() [943/4950]

x species_pp_groundstate_structure push_back ( "N/A_3bb9944485caf6e7"  )

◆ push_back() [944/4950]

x vTITEL push_back ( "PAWCo03Mar1998"  )

◆ push_back() [945/4950]

x species_pp_version push_back ( "Co:PAW_LDA:03Mar1998"  )

◆ push_back() [946/4950]

x species_pp_AUID push_back ( "23d97019de916d58"  )

◆ push_back() [947/4950]

x vTITEL push_back ( "PAWC31May2000"  )

◆ push_back() [948/4950]

x species_pp_version push_back ( "C:PAW_LDA:31May2000"  )

◆ push_back() [949/4950]

x species_pp_AUID push_back ( "9e8ca933cd7d349f"  )

◆ push_back() [950/4950]

x vTITEL push_back ( "PAWCr03Mar1998"  )

◆ push_back() [951/4950]

x species_pp_version push_back ( "Cr:PAW_LDA:03Mar1998"  )

◆ push_back() [952/4950]

x species_pp_AUID push_back ( "46e25663256eec1e"  )

◆ push_back() [953/4950]

x vEATOM push_back ( 278.  9312)

◆ push_back() [954/4950]

x vTITEL push_back ( "PAWCr_pv07Sep2000"  )

◆ push_back() [955/4950]

x species_pp push_back ( "Cr_pv"  )

◆ push_back() [956/4950]

x species_pp_version push_back ( "Cr_pv:PAW_LDA:07Sep2000"  )

◆ push_back() [957/4950]

x species_pp_AUID push_back ( "e56aa7dff1571851"  )

◆ push_back() [958/4950]

x vEATOM push_back ( 1650.  3855)

◆ push_back() [959/4950]

x vTITEL push_back ( "PAWC_s04May1998"  )

◆ push_back() [960/4950]

x species_pp_version push_back ( "C_s:PAW_LDA:04May1998"  )

◆ push_back() [961/4950]

x species_pp_AUID push_back ( "459fb1e14999a1a8"  )

◆ push_back() [962/4950]

x vTITEL push_back ( "PAWCs_sv07Sep2000"  )

◆ push_back() [963/4950]

x species_pp push_back ( "Cs_sv"  )

◆ push_back() [964/4950]

x species_pp_version push_back ( "Cs_sv:PAW_LDA:07Sep2000"  )

◆ push_back() [965/4950]

x species_pp_AUID push_back ( "47d2b2b79b3bb561"  )

◆ push_back() [966/4950]

x vEATOM push_back ( 558.  537)

◆ push_back() [967/4950]

x vTITEL push_back ( "PAWCu03Mar1998"  )

◆ push_back() [968/4950]

x species_pp_version push_back ( "Cu:PAW_LDA:03Mar1998"  )

◆ push_back() [969/4950]

x species_pp_AUID push_back ( "920126d2172870b5"  )

◆ push_back() [970/4950]

x vEATOM push_back ( 1395.  6602)

◆ push_back() [971/4950]

x vTITEL push_back ( "PAWCu_pv19Apr2000"  )

◆ push_back() [972/4950]

x species_pp push_back ( "Cu_pv"  )

◆ push_back() [973/4950]

x species_pp_version push_back ( "Cu_pv:PAW_LDA:19Apr2000"  )

◆ push_back() [974/4950]

x species_pp_AUID push_back ( "1794dd824ade7bfb"  )

◆ push_back() [975/4950]

x vEATOM push_back ( 4124.  1158)

◆ push_back() [976/4950]

x vTITEL push_back ( "PAWFe03Mar1998"  )

◆ push_back() [977/4950]

x species_pp_version push_back ( "Fe:PAW_LDA:03Mar1998"  )

◆ push_back() [978/4950]

x species_pp_AUID push_back ( "24dd99c81a522c7f"  )

◆ push_back() [979/4950]

x vEATOM push_back ( 597.  365)

◆ push_back() [980/4950]

x vTITEL push_back ( "PAWFe_pv03Mar1998"  )

◆ push_back() [981/4950]

x species_pp push_back ( "Fe_pv"  )

◆ push_back() [982/4950]

x species_pp_version push_back ( "Fe_pv:PAW_LDA:03Mar1998"  )

◆ push_back() [983/4950]

x species_pp_AUID push_back ( "ea29acbd64d22bd0"  )

◆ push_back() [984/4950]

x vEATOM push_back ( 2460.  58)

◆ push_back() [985/4950]

x vTITEL push_back ( "PAWF_h17Apr2000"  )

◆ push_back() [986/4950]

x species_pp push_back ( "F_h"  )

◆ push_back() [987/4950]

x species_pp_version push_back ( "F_h:PAW_LDA:17Apr2000"  )

◆ push_back() [988/4950]

x species_pp_AUID push_back ( "727217302f2d8e50"  )

◆ push_back() [989/4950]

x species_pp_groundstate_structure push_back ( "N/A_727217302f2d8e50"  )

◆ push_back() [990/4950]

x vEATOM push_back ( 658.  3801)

◆ push_back() [991/4950]

x vTITEL push_back ( "PAWF31May2000"  )

◆ push_back() [992/4950]

x species_pp_version push_back ( "F:PAW_LDA:31May2000"  )

◆ push_back() [993/4950]

x species_pp_AUID push_back ( "110c50a29a0b004d"  )

◆ push_back() [994/4950]

x species_pp_groundstate_structure push_back ( "N/A_110c50a29a0b004d"  )

◆ push_back() [995/4950]

x vTITEL push_back ( "PAWF_s04May1998"  )

◆ push_back() [996/4950]

x species_pp_version push_back ( "F_s:PAW_LDA:04May1998"  )

◆ push_back() [997/4950]

x species_pp_AUID push_back ( "4ea300a94d34ea07"  )

◆ push_back() [998/4950]

x species_pp_groundstate_structure push_back ( "N/A_4ea300a94d34ea07"  )

◆ push_back() [999/4950]

x vTITEL push_back ( "PAWGa_d03Mar1998"  )

◆ push_back() [1000/4950]

x species_pp push_back ( "Ga_d"  )

◆ push_back() [1001/4950]

x species_pp_version push_back ( "Ga_d:PAW_LDA:03Mar1998"  )

◆ push_back() [1002/4950]

x species_pp_AUID push_back ( "e649ceaaaf4cea48"  )

◆ push_back() [1003/4950]

x species_pp_groundstate_structure push_back ( "N/A_e649ceaaaf4cea48"  )

◆ push_back() [1004/4950]

x vEATOM push_back ( 2154.  4866)

◆ push_back() [1005/4950]

x vTITEL push_back ( "PAWGa_h21Jan2003"  )

◆ push_back() [1006/4950]

x species_pp push_back ( "Ga_h"  )

◆ push_back() [1007/4950]

x species_pp_version push_back ( "Ga_h:PAW_LDA:21Jan2003"  )

◆ push_back() [1008/4950]

x species_pp_AUID push_back ( "806c4d79cd2e6f99"  )

◆ push_back() [1009/4950]

x species_pp_groundstate_structure push_back ( "N/A_806c4d79cd2e6f99"  )

◆ push_back() [1010/4950]

x vTITEL push_back ( "PAWGa03Oct2001"  )

◆ push_back() [1011/4950]

x species_pp_version push_back ( "Ga:PAW_LDA:03Oct2001"  )

◆ push_back() [1012/4950]

x species_pp_AUID push_back ( "3c7ea9f86d370ab0"  )

◆ push_back() [1013/4950]

x species_pp_groundstate_structure push_back ( "N/A_3c7ea9f86d370ab0"  )

◆ push_back() [1014/4950]

x vEATOM push_back ( 59.  762)

◆ push_back() [1015/4950]

x vTITEL push_back ( "PAWGe_d03Mar1998"  )

◆ push_back() [1016/4950]

x species_pp push_back ( "Ge_d"  )

◆ push_back() [1017/4950]

x species_pp_version push_back ( "Ge_d:PAW_LDA:03Mar1998"  )

◆ push_back() [1018/4950]

x species_pp_AUID push_back ( "4538ff07d45d4093"  )

◆ push_back() [1019/4950]

x vEATOM push_back ( 2602.  3767)

◆ push_back() [1020/4950]

x vTITEL push_back ( "PAWGe_h21Jan2003"  )

◆ push_back() [1021/4950]

x species_pp push_back ( "Ge_h"  )

◆ push_back() [1022/4950]

x species_pp_version push_back ( "Ge_h:PAW_LDA:21Jan2003"  )

◆ push_back() [1023/4950]

x species_pp_AUID push_back ( "efd53a76a6f5032e"  )

◆ push_back() [1024/4950]

x vTITEL push_back ( "PAWGe03Mar1998"  )

◆ push_back() [1025/4950]

x species_pp_version push_back ( "Ge:PAW_LDA:03Mar1998"  )

◆ push_back() [1026/4950]

x species_pp_AUID push_back ( "e8adcacdfca69c78"  )

◆ push_back() [1027/4950]

x vEATOM push_back ( 106.  1908)

◆ push_back() [1028/4950]

x vTITEL push_back ( "PAWH1.2514Feb2000"  )

◆ push_back() [1029/4950]

x species_pp push_back ( "H1.25"  )

◆ push_back() [1030/4950]

x species_pp_version push_back ( "H1.25:PAW_LDA:14Feb2000"  )

◆ push_back() [1031/4950]

x species_pp_AUID push_back ( "36286c99b6fa5ea9"  )

◆ push_back() [1032/4950]

x species_pp_groundstate_structure push_back ( "N/A_36286c99b6fa5ea9"  )

◆ push_back() [1033/4950]

x vTITEL push_back ( "PAWH1.507Sep2000"  )

◆ push_back() [1034/4950]

x species_pp push_back ( "H1.5"  )

◆ push_back() [1035/4950]

x species_pp_version push_back ( "H1.5:PAW_LDA:07Sep2000"  )

◆ push_back() [1036/4950]

x species_pp_AUID push_back ( "aacfc8d177143f1d"  )

◆ push_back() [1037/4950]

x species_pp_groundstate_structure push_back ( "N/A_aacfc8d177143f1d"  )

◆ push_back() [1038/4950]

x vEATOM push_back ( 35.  3498)

◆ push_back() [1039/4950]

x vTITEL push_back ( "PAWH.507Sep2000"  )

◆ push_back() [1040/4950]

x species_pp push_back ( "H.5"  )

◆ push_back() [1041/4950]

x species_pp_version push_back ( "H.5:PAW_LDA:07Sep2000"  )

◆ push_back() [1042/4950]

x species_pp_AUID push_back ( "0c56d5ecf47a15e9"  )

◆ push_back() [1043/4950]

x species_pp_groundstate_structure push_back ( "N/A_0c56d5ecf47a15e9"  )

◆ push_back() [1044/4950]

x vTITEL push_back ( "PAWH.7507Sep2000"  )

◆ push_back() [1045/4950]

x species_pp push_back ( "H.75"  )

◆ push_back() [1046/4950]

x species_pp_version push_back ( "H.75:PAW_LDA:07Sep2000"  )

◆ push_back() [1047/4950]

x species_pp_AUID push_back ( "c0ec2ef9e87e4543"  )

◆ push_back() [1048/4950]

x species_pp_groundstate_structure push_back ( "N/A_c0ec2ef9e87e4543"  )

◆ push_back() [1049/4950]

x vTITEL push_back ( "PAWHe07Sep2000"  )

◆ push_back() [1050/4950]

x species_pp push_back ( "He"  )

◆ push_back() [1051/4950]

x species_Z push_back ( )

◆ push_back() [1052/4950]

x species_pp_version push_back ( "He:PAW_LDA:07Sep2000"  )

◆ push_back() [1053/4950]

x species_pp_AUID push_back ( "60575574eefd1ae1"  )

◆ push_back() [1054/4950]

x vEATOM push_back ( 77.  1248)

◆ push_back() [1055/4950]

x vTITEL push_back ( "PAWHf21Jan2003"  )

◆ push_back() [1056/4950]

x species_pp_version push_back ( "Hf:PAW_LDA:21Jan2003"  )

◆ push_back() [1057/4950]

x species_pp_AUID push_back ( "5e77afe83e49db7f"  )

◆ push_back() [1058/4950]

x vTITEL push_back ( "PAWHf_pv17Apr2000"  )

◆ push_back() [1059/4950]

x species_pp push_back ( "Hf_pv"  )

◆ push_back() [1060/4950]

x species_pp_version push_back ( "Hf_pv:PAW_LDA:17Apr2000"  )

◆ push_back() [1061/4950]

x species_pp_AUID push_back ( "95ae304e242d499a"  )

◆ push_back() [1062/4950]

x vEATOM push_back ( 863.  8571)

◆ push_back() [1063/4950]

x vTITEL push_back ( "PAWHg04Feb1998"  )

◆ push_back() [1064/4950]

x species_pp_version push_back ( "Hg:PAW_LDA:04Feb1998"  )

◆ push_back() [1065/4950]

x species_pp_AUID push_back ( "85cf414c5473e942"  )

◆ push_back() [1066/4950]

x vEATOM push_back ( 1152.  2246)

◆ push_back() [1067/4950]

x vTITEL push_back ( "PAWH_h04May1998"  )

◆ push_back() [1068/4950]

x species_pp push_back ( "H_h"  )

◆ push_back() [1069/4950]

x species_pp_version push_back ( "H_h:PAW_LDA:04May1998"  )

◆ push_back() [1070/4950]

x species_pp_AUID push_back ( "8c05388d0dd0cefa"  )

◆ push_back() [1071/4950]

x species_pp_groundstate_structure push_back ( "N/A_8c05388d0dd0cefa"  )

◆ push_back() [1072/4950]

x vTITEL push_back ( "PAWH06May1998"  )

◆ push_back() [1073/4950]

x species_pp_version push_back ( "H:PAW_LDA:06May1998"  )

◆ push_back() [1074/4950]

x species_pp_AUID push_back ( "c1b13c85b4846b59"  )

◆ push_back() [1075/4950]

x species_pp_groundstate_structure push_back ( "N/A_c1b13c85b4846b59"  )

◆ push_back() [1076/4950]

x vTITEL push_back ( "PAWIn_d11Feb1998"  )

◆ push_back() [1077/4950]

x species_pp push_back ( "In_d"  )

◆ push_back() [1078/4950]

x species_pp_version push_back ( "In_d:PAW_LDA:11Feb1998"  )

◆ push_back() [1079/4950]

x species_pp_AUID push_back ( "736bc14298ccbdda"  )

◆ push_back() [1080/4950]

x species_pp_groundstate_structure push_back ( "N/A_736bc14298ccbdda"  )

◆ push_back() [1081/4950]

x vEATOM push_back ( 1580.  0454)

◆ push_back() [1082/4950]

x vTITEL push_back ( "PAWIn03Oct2001"  )

◆ push_back() [1083/4950]

x species_pp_version push_back ( "In:PAW_LDA:03Oct2001"  )

◆ push_back() [1084/4950]

x species_pp_AUID push_back ( "b605218ff5776639"  )

◆ push_back() [1085/4950]

x species_pp_groundstate_structure push_back ( "N/A_b605218ff5776639"  )

◆ push_back() [1086/4950]

x vEATOM push_back ( 54.  8315)

◆ push_back() [1087/4950]

x vTITEL push_back ( "PAWI03Oct2001"  )

◆ push_back() [1088/4950]

x species_pp_version push_back ( "I:PAW_LDA:03Oct2001"  )

◆ push_back() [1089/4950]

x species_pp_AUID push_back ( "b0c82281da077d90"  )

◆ push_back() [1090/4950]

x species_pp_groundstate_structure push_back ( "N/A_b0c82281da077d90"  )

◆ push_back() [1091/4950]

x vEATOM push_back ( 318.  2436)

◆ push_back() [1092/4950]

x vTITEL push_back ( "PAWIr10Feb1998"  )

◆ push_back() [1093/4950]

x species_pp_version push_back ( "Ir:PAW_LDA:10Feb1998"  )

◆ push_back() [1094/4950]

x species_pp_AUID push_back ( "78171971d3315e28"  )

◆ push_back() [1095/4950]

x vEATOM push_back ( 563.  0478)

◆ push_back() [1096/4950]

x vTITEL push_back ( "PAWK_pv02Feb1998"  )

◆ push_back() [1097/4950]

x species_pp push_back ( "K_pv"  )

◆ push_back() [1098/4950]

x species_pp_version push_back ( "K_pv:PAW_LDA:02Feb1998"  )

◆ push_back() [1099/4950]

x species_pp_AUID push_back ( "57bec8a3e025c3e4"  )

◆ push_back() [1100/4950]

x vEATOM push_back ( 451.  4858)

◆ push_back() [1101/4950]

x vTITEL push_back ( "PAWKr07Sep2000"  )

◆ push_back() [1102/4950]

x species_pp_version push_back ( "Kr:PAW_LDA:07Sep2000"  )

◆ push_back() [1103/4950]

x species_pp_AUID push_back ( "646125261b6e1be0"  )

◆ push_back() [1104/4950]

x species_pp_groundstate_structure push_back ( "N/A_646125261b6e1be0"  )

◆ push_back() [1105/4950]

x vEATOM push_back ( 508.  9461)

◆ push_back() [1106/4950]

x vTITEL push_back ( "PAWK_sv24Mar1998"  )

◆ push_back() [1107/4950]

x species_pp push_back ( "K_sv"  )

◆ push_back() [1108/4950]

x species_pp_version push_back ( "K_sv:PAW_LDA:24Mar1998"  )

◆ push_back() [1109/4950]

x species_pp_AUID push_back ( "85c370c6dd5f769e"  )

◆ push_back() [1110/4950]

x vEATOM push_back ( 775.  5734)

◆ push_back() [1111/4950]

x vTITEL push_back ( "PAWLa17Apr2000"  )

◆ push_back() [1112/4950]

x species push_back ( "La"  )

◆ push_back() [1113/4950]

x species_Z push_back ( 57  )

◆ push_back() [1114/4950]

x species_pp_version push_back ( "La:PAW_LDA:17Apr2000"  )

◆ push_back() [1115/4950]

x species_pp_AUID push_back ( "d0888fff3f31a114"  )

◆ push_back() [1116/4950]

x vEATOM push_back ( 869.  4274)

◆ push_back() [1117/4950]

x vTITEL push_back ( "PAWLa_s17Apr2000"  )

◆ push_back() [1118/4950]

x species_pp push_back ( "La_s"  )

◆ push_back() [1119/4950]

x species_pp_version push_back ( "La_s:PAW_LDA:17Apr2000"  )

◆ push_back() [1120/4950]

x species_pp_AUID push_back ( "0549ee555a0b18c8"  )

◆ push_back() [1121/4950]

x vEATOM push_back ( 547.  2663)

◆ push_back() [1122/4950]

x vTITEL push_back ( "PAWLi21Jan2003"  )

◆ push_back() [1123/4950]

x species_pp_version push_back ( "Li:PAW_LDA:21Jan2003"  )

◆ push_back() [1124/4950]

x species_pp_AUID push_back ( "e3ad72d8dbbd284c"  )

◆ push_back() [1125/4950]

x vTITEL push_back ( "PAWLi_sv19Jan2001"  )

◆ push_back() [1126/4950]

x species_pp push_back ( "Li_sv"  )

◆ push_back() [1127/4950]

x species_pp_version push_back ( "Li_sv:PAW_LDA:19Jan2001"  )

◆ push_back() [1128/4950]

x species_pp_AUID push_back ( "c680d72aeb02882e"  )

◆ push_back() [1129/4950]

x vEATOM push_back ( 199.  5738)

◆ push_back() [1130/4950]

x vTITEL push_back ( "PAWMg02Mar1998"  )

◆ push_back() [1131/4950]

x species_pp_version push_back ( "Mg:PAW_LDA:02Mar1998"  )

◆ push_back() [1132/4950]

x species_pp_AUID push_back ( "b3d0cc0187ea8112"  )

◆ push_back() [1133/4950]

x vEATOM push_back ( 23.  1864)

◆ push_back() [1134/4950]

x vTITEL push_back ( "PAWMg_pv02Mar1998"  )

◆ push_back() [1135/4950]

x species_pp push_back ( "Mg_pv"  )

◆ push_back() [1136/4950]

x species_pp_version push_back ( "Mg_pv:PAW_LDA:02Mar1998"  )

◆ push_back() [1137/4950]

x species_pp_AUID push_back ( "c2b2c35b8213a287"  )

◆ push_back() [1138/4950]

x vEATOM push_back ( 1057.  2317)

◆ push_back() [1139/4950]

x vTITEL push_back ( "PAWMn03Mar1998"  )

◆ push_back() [1140/4950]

x species_pp_version push_back ( "Mn:PAW_LDA:03Mar1998"  )

◆ push_back() [1141/4950]

x species_pp_AUID push_back ( "a02e8b7f63c28308"  )

◆ push_back() [1142/4950]

x species_pp_groundstate_structure push_back ( "N/A_a02e8b7f63c28308"  )

◆ push_back() [1143/4950]

x vEATOM push_back ( 419.  2896)

◆ push_back() [1144/4950]

x vTITEL push_back ( "PAWMn_pv07Sep2000"  )

◆ push_back() [1145/4950]

x species_pp push_back ( "Mn_pv"  )

◆ push_back() [1146/4950]

x species_pp_version push_back ( "Mn_pv:PAW_LDA:07Sep2000"  )

◆ push_back() [1147/4950]

x species_pp_AUID push_back ( "c22cba7e474bd9df"  )

◆ push_back() [1148/4950]

x species_pp_groundstate_structure push_back ( "N/A_c22cba7e474bd9df"  )

◆ push_back() [1149/4950]

x vEATOM push_back ( 2028.  0469)

◆ push_back() [1150/4950]

x vTITEL push_back ( "PAW_PBEMo08Apr2002"  )

◆ push_back() [1151/4950]

x species_pp_type push_back ( "PAW_PBE"  )

◆ push_back() [1152/4950]

x species_pp_version push_back ( "Mo:PAW_PBE:08Apr2002"  )

◆ push_back() [1153/4950]

x species_pp_AUID push_back ( "c576eca6dcb6ca20"  )

◆ push_back() [1154/4950]

x species_pp_groundstate_structure push_back ( "N/A_c576eca6dcb6ca20"  )

◆ push_back() [1155/4950]

x vEATOM push_back ( 218.  8581)

◆ push_back() [1156/4950]

x vTITEL push_back ( "PAWMo_pv08Jan2002"  )

◆ push_back() [1157/4950]

x species_pp push_back ( "Mo_pv"  )

◆ push_back() [1158/4950]

x species_pp_version push_back ( "Mo_pv:PAW_LDA:08Jan2002"  )

◆ push_back() [1159/4950]

x species_pp_AUID push_back ( "517b9d282b85b101"  )

◆ push_back() [1160/4950]

x vEATOM push_back ( 1287.  5298)

◆ push_back() [1161/4950]

x vTITEL push_back ( "PAWMo_sv15Nov2001"  )

◆ push_back() [1162/4950]

x species_pp push_back ( "Mo_sv"  )

◆ push_back() [1163/4950]

x species_pp_version push_back ( "Mo_sv:PAW_LDA:15Nov2001"  )

◆ push_back() [1164/4950]

x species_pp_AUID push_back ( "027c5a9d41c6523f"  )

◆ push_back() [1165/4950]

x vEATOM push_back ( 1865.  6176)

◆ push_back() [1166/4950]

x vTITEL push_back ( "PAWNa24Mar1998"  )

◆ push_back() [1167/4950]

x species_pp_version push_back ( "Na:PAW_LDA:24Mar1998"  )

◆ push_back() [1168/4950]

x species_pp_AUID push_back ( "2215677fd2f98aea"  )

◆ push_back() [1169/4950]

x species_pp_groundstate_structure push_back ( "A2/A7"  )

◆ push_back() [1170/4950]

x vTITEL push_back ( "PAWNa_pv28Sep2000"  )

◆ push_back() [1171/4950]

x species_pp push_back ( "Na_pv"  )

◆ push_back() [1172/4950]

x species_pp_version push_back ( "Na_pv:PAW_LDA:28Sep2000"  )

◆ push_back() [1173/4950]

x species_pp_AUID push_back ( "b994b2842f3b80ab"  )

◆ push_back() [1174/4950]

x vEATOM push_back ( 766.  6936)

◆ push_back() [1175/4950]

x vTITEL push_back ( "PAWNa_sv28Sep2000"  )

◆ push_back() [1176/4950]

x species_pp push_back ( "Na_sv"  )

◆ push_back() [1177/4950]

x species_pp_version push_back ( "Na_sv:PAW_LDA:28Sep2000"  )

◆ push_back() [1178/4950]

x species_pp_AUID push_back ( "189d870b4537263b"  )

◆ push_back() [1179/4950]

x vEATOM push_back ( 1305.  4804)

◆ push_back() [1180/4950]

x vTITEL push_back ( "PAWNb_pv09Jan2002"  )

◆ push_back() [1181/4950]

x species_pp push_back ( "Nb_pv"  )

◆ push_back() [1182/4950]

x species_pp_version push_back ( "Nb_pv:PAW_LDA:09Jan2002"  )

◆ push_back() [1183/4950]

x species_pp_AUID push_back ( "73b4ad5a036338fa"  )

◆ push_back() [1184/4950]

x vEATOM push_back ( 1046.  374)

◆ push_back() [1185/4950]

x vTITEL push_back ( "PAWNb_sv15Nov2001"  )

◆ push_back() [1186/4950]

x species_pp push_back ( "Nb_sv"  )

◆ push_back() [1187/4950]

x species_pp_version push_back ( "Nb_sv:PAW_LDA:15Nov2001"  )

◆ push_back() [1188/4950]

x species_pp_AUID push_back ( "9fdcd7998786bd34"  )

◆ push_back() [1189/4950]

x vEATOM push_back ( 1558.  3724)

◆ push_back() [1190/4950]

x vTITEL push_back ( "PAWNe07Sep2000"  )

◆ push_back() [1191/4950]

x species_pp_version push_back ( "Ne:PAW_LDA:07Sep2000"  )

◆ push_back() [1192/4950]

x species_pp_AUID push_back ( "bf15cfac49144396"  )

◆ push_back() [1193/4950]

x vEATOM push_back ( 953.  6342)

◆ push_back() [1194/4950]

x vTITEL push_back ( "PAWN_h17Apr2000"  )

◆ push_back() [1195/4950]

x species_pp push_back ( "N_h"  )

◆ push_back() [1196/4950]

x species_pp_version push_back ( "N_h:PAW_LDA:17Apr2000"  )

◆ push_back() [1197/4950]

x species_pp_AUID push_back ( "71fd481a6e73b8d9"  )

◆ push_back() [1198/4950]

x species_pp_groundstate_structure push_back ( "N/A_71fd481a6e73b8d9"  )

◆ push_back() [1199/4950]

x vEATOM push_back ( 263.  8773)

◆ push_back() [1200/4950]

x vTITEL push_back ( "PAWNi03Mar1998"  )

◆ push_back() [1201/4950]

x species_pp_version push_back ( "Ni:PAW_LDA:03Mar1998"  )

◆ push_back() [1202/4950]

x species_pp_AUID push_back ( "5737f6f3ba793dbe"  )

◆ push_back() [1203/4950]

x vEATOM push_back ( 1081.  8021)

◆ push_back() [1204/4950]

x vTITEL push_back ( "PAWNi_pv19Apr2000"  )

◆ push_back() [1205/4950]

x species_pp push_back ( "Ni_pv"  )

◆ push_back() [1206/4950]

x species_pp_version push_back ( "Ni_pv:PAW_LDA:19Apr2000"  )

◆ push_back() [1207/4950]

x species_pp_AUID push_back ( "bee457b2befa4114"  )

◆ push_back() [1208/4950]

x vEATOM push_back ( 3504.  8643)

◆ push_back() [1209/4950]

x vTITEL push_back ( "PAWN31May2000"  )

◆ push_back() [1210/4950]

x species_pp_version push_back ( "N:PAW_LDA:31May2000"  )

◆ push_back() [1211/4950]

x species_pp_AUID push_back ( "278cac490c661847"  )

◆ push_back() [1212/4950]

x species_pp_groundstate_structure push_back ( "N/A_278cac490c661847"  )

◆ push_back() [1213/4950]

x vTITEL push_back ( "PAWNp17Apr2000"  )

◆ push_back() [1214/4950]

x species push_back ( "Np"  )

◆ push_back() [1215/4950]

x species_Z push_back ( 93  )

◆ push_back() [1216/4950]

x species_pp_version push_back ( "Np:PAW_LDA:17Apr2000"  )

◆ push_back() [1217/4950]

x species_pp_AUID push_back ( "0fd1cebfee7e843e"  )

◆ push_back() [1218/4950]

x species_pp_groundstate_structure push_back ( "N/A_0fd1cebfee7e843e"  )

◆ push_back() [1219/4950]

x vTITEL push_back ( "PAWNp_s04May2000"  )

◆ push_back() [1220/4950]

x species_pp push_back ( "Np_s"  )

◆ push_back() [1221/4950]

x species_pp_version push_back ( "Np_s:PAW_LDA:04May2000"  )

◆ push_back() [1222/4950]

x species_pp_AUID push_back ( "23070fd48393aaee"  )

◆ push_back() [1223/4950]

x species_pp_groundstate_structure push_back ( "N/A_23070fd48393aaee"  )

◆ push_back() [1224/4950]

x vTITEL push_back ( "PAWN_s04May1998"  )

◆ push_back() [1225/4950]

x species_pp_version push_back ( "N_s:PAW_LDA:04May1998"  )

◆ push_back() [1226/4950]

x species_pp_AUID push_back ( "1811ac62de7b62d0"  )

◆ push_back() [1227/4950]

x species_pp_groundstate_structure push_back ( "N/A_1811ac62de7b62d0"  )

◆ push_back() [1228/4950]

x vTITEL push_back ( "PAWO_h17Apr2000"  )

◆ push_back() [1229/4950]

x species_pp push_back ( "O_h"  )

◆ push_back() [1230/4950]

x species_pp_version push_back ( "O_h:PAW_LDA:17Apr2000"  )

◆ push_back() [1231/4950]

x species_pp_AUID push_back ( "11288e796ef56094"  )

◆ push_back() [1232/4950]

x species_pp_groundstate_structure push_back ( "N/A_11288e796ef56094"  )

◆ push_back() [1233/4950]

x vEATOM push_back ( 431.  4447)

◆ push_back() [1234/4950]

x vTITEL push_back ( "PAWO31May2000"  )

◆ push_back() [1235/4950]

x species_pp_version push_back ( "O:PAW_LDA:31May2000"  )

◆ push_back() [1236/4950]

x species_pp_AUID push_back ( "c7dc8a39d50862bd"  )

◆ push_back() [1237/4950]

x species_pp_groundstate_structure push_back ( "N/A_c7dc8a39d50862bd"  )

◆ push_back() [1238/4950]

x vTITEL push_back ( "PAWO_s06May1998"  )

◆ push_back() [1239/4950]

x species_pp_version push_back ( "O_s:PAW_LDA:06May1998"  )

◆ push_back() [1240/4950]

x species_pp_AUID push_back ( "2d0cb1247e2dd531"  )

◆ push_back() [1241/4950]

x species_pp_groundstate_structure push_back ( "N/A_2d0cb1247e2dd531"  )

◆ push_back() [1242/4950]

x vTITEL push_back ( "PAWOs21Jan2003"  )

◆ push_back() [1243/4950]

x species_pp_version push_back ( "Os:PAW_LDA:21Jan2003"  )

◆ push_back() [1244/4950]

x species_pp_AUID push_back ( "d38b52b3db36dc96"  )

◆ push_back() [1245/4950]

x vEATOM push_back ( 420.  1599)

◆ push_back() [1246/4950]

x vTITEL push_back ( "PAWOs_pv10Feb1998"  )

◆ push_back() [1247/4950]

x species_pp push_back ( "Os_pv"  )

◆ push_back() [1248/4950]

x species_pp_version push_back ( "Os_pv:PAW_LDA:10Feb1998"  )

◆ push_back() [1249/4950]

x species_pp_AUID push_back ( "6948d5b374665a4d"  )

◆ push_back() [1250/4950]

x vEATOM push_back ( 1784.  6368)

◆ push_back() [1251/4950]

x vTITEL push_back ( "PAWPa17Apr2000"  )

◆ push_back() [1252/4950]

x species push_back ( "Pa"  )

◆ push_back() [1253/4950]

x species_Z push_back ( 91  )

◆ push_back() [1254/4950]

x species_pp_version push_back ( "Pa:PAW_LDA:17Apr2000"  )

◆ push_back() [1255/4950]

x species_pp_AUID push_back ( "4843b89680ec31a7"  )

◆ push_back() [1256/4950]

x species_pp_groundstate_structure push_back ( "N/A_4843b89680ec31a7"  )

◆ push_back() [1257/4950]

x vEATOM push_back ( 1184.  0696)

◆ push_back() [1258/4950]

x vTITEL push_back ( "PAWPa_s12Apr2000"  )

◆ push_back() [1259/4950]

x species_pp push_back ( "Pa_s"  )

◆ push_back() [1260/4950]

x species_pp_version push_back ( "Pa_s:PAW_LDA:12Apr2000"  )

◆ push_back() [1261/4950]

x species_pp_AUID push_back ( "af6713f976d7ff77"  )

◆ push_back() [1262/4950]

x species_pp_groundstate_structure push_back ( "N/A_af6713f976d7ff77"  )

◆ push_back() [1263/4950]

x vEATOM push_back ( 784.  8288)

◆ push_back() [1264/4950]

x vTITEL push_back ( "PAWPb_d30Apr1998"  )

◆ push_back() [1265/4950]

x species_pp_version push_back ( "Pb_d:PAW_LDA:30Apr1998"  )

◆ push_back() [1266/4950]

x species_pp_AUID push_back ( "1010cb02b8b71033"  )

◆ push_back() [1267/4950]

x vTITEL push_back ( "PAWPb02Sep2001"  )

◆ push_back() [1268/4950]

x species_pp_version push_back ( "Pb:PAW_LDA:02Sep2001"  )

◆ push_back() [1269/4950]

x species_pp_AUID push_back ( "381b125c2959cfe6"  )

◆ push_back() [1270/4950]

x vEATOM push_back ( 98.  3102)

◆ push_back() [1271/4950]

x vTITEL push_back ( "PAWPd09Oct1998"  )

◆ push_back() [1272/4950]

x species_pp_version push_back ( "Pd:PAW_LDA:09Oct1998"  )

◆ push_back() [1273/4950]

x species_pp_AUID push_back ( "3b6d075d41b9645f"  )

◆ push_back() [1274/4950]

x vEATOM push_back ( 811.  9756)

◆ push_back() [1275/4950]

x vTITEL push_back ( "PAWPd_pv17Apr2000"  )

◆ push_back() [1276/4950]

x species_pp push_back ( "Pd_pv"  )

◆ push_back() [1277/4950]

x species_pp_version push_back ( "Pd_pv:PAW_LDA:17Apr2000"  )

◆ push_back() [1278/4950]

x species_pp_AUID push_back ( "4158852ee0320965"  )

◆ push_back() [1279/4950]

x vEATOM push_back ( 2625.  7488)

◆ push_back() [1280/4950]

x vTITEL push_back ( "PAWP_h21Jan2003"  )

◆ push_back() [1281/4950]

x species_pp push_back ( "P_h"  )

◆ push_back() [1282/4950]

x species_pp_version push_back ( "P_h:PAW_LDA:21Jan2003"  )

◆ push_back() [1283/4950]

x species_pp_AUID push_back ( "3329a6c02a55dc9f"  )

◆ push_back() [1284/4950]

x species_pp_groundstate_structure push_back ( "N/A_3329a6c02a55dc9f"  )

◆ push_back() [1285/4950]

x vEATOM push_back ( 176.  5121)

◆ push_back() [1286/4950]

x vTITEL push_back ( "PAWP21Jan2003"  )

◆ push_back() [1287/4950]

x species_pp_version push_back ( "P:PAW_LDA:21Jan2003"  )

◆ push_back() [1288/4950]

x species_pp_AUID push_back ( "98597a1cef3bf372"  )

◆ push_back() [1289/4950]

x species_pp_groundstate_structure push_back ( "N/A_98597a1cef3bf372"  )

◆ push_back() [1290/4950]

x vTITEL push_back ( "PAWPt17Apr2000"  )

◆ push_back() [1291/4950]

x species_pp_version push_back ( "Pt:PAW_LDA:17Apr2000"  )

◆ push_back() [1292/4950]

x species_pp_AUID push_back ( "2f9c34be5eee2bc7"  )

◆ push_back() [1293/4950]

x vTITEL push_back ( "PAWPu17Apr2000"  )

◆ push_back() [1294/4950]

x species push_back ( "Pu"  )

◆ push_back() [1295/4950]

x species_Z push_back ( 94  )

◆ push_back() [1296/4950]

x species_pp_version push_back ( "Pu:PAW_LDA:17Apr2000"  )

◆ push_back() [1297/4950]

x species_pp_AUID push_back ( "1979502586767b20"  )

◆ push_back() [1298/4950]

x species_pp_groundstate_structure push_back ( "N/A_1979502586767b20"  )

◆ push_back() [1299/4950]

x vEATOM push_back ( 1953.  8486)

◆ push_back() [1300/4950]

x vTITEL push_back ( "PAWPu_s04May2000"  )

◆ push_back() [1301/4950]

x species_pp push_back ( "Pu_s"  )

◆ push_back() [1302/4950]

x species_pp_version push_back ( "Pu_s:PAW_LDA:04May2000"  )

◆ push_back() [1303/4950]

x species_pp_AUID push_back ( "f7ca05edd6975ddd"  )

◆ push_back() [1304/4950]

x species_pp_groundstate_structure push_back ( "N/A_f7ca05edd6975ddd"  )

◆ push_back() [1305/4950]

x vTITEL push_back ( "PAWRb_pv11Feb1998"  )

◆ push_back() [1306/4950]

x species_pp push_back ( "Rb_pv"  )

◆ push_back() [1307/4950]

x species_pp_version push_back ( "Rb_pv:PAW_LDA:11Feb1998"  )

◆ push_back() [1308/4950]

x species_pp_AUID push_back ( "688256fb12391100"  )

◆ push_back() [1309/4950]

x species_pp_groundstate_structure push_back ( "N/A_688256fb12391100"  )

◆ push_back() [1310/4950]

x vEATOM push_back ( 382.  0818)

◆ push_back() [1311/4950]

x vTITEL push_back ( "PAWRb_sv10Feb1998"  )

◆ push_back() [1312/4950]

x species_pp push_back ( "Rb_sv"  )

◆ push_back() [1313/4950]

x species_pp_version push_back ( "Rb_sv:PAW_LDA:10Feb1998"  )

◆ push_back() [1314/4950]

x species_pp_AUID push_back ( "602430f73654d2a6"  )

◆ push_back() [1315/4950]

x species_pp_groundstate_structure push_back ( "N/A_602430f73654d2a6"  )

◆ push_back() [1316/4950]

x vEATOM push_back ( 664.  872)

◆ push_back() [1317/4950]

x vTITEL push_back ( "PAWRe21Jan2003"  )

◆ push_back() [1318/4950]

x species_pp_version push_back ( "Re:PAW_LDA:21Jan2003"  )

◆ push_back() [1319/4950]

x species_pp_AUID push_back ( "7289c4501ec2c23a"  )

◆ push_back() [1320/4950]

x vEATOM push_back ( 301.  9135)

◆ push_back() [1321/4950]

x vTITEL push_back ( "PAWRe_pv11Feb1998"  )

◆ push_back() [1322/4950]

x species_pp push_back ( "Re_pv"  )

◆ push_back() [1323/4950]

x species_pp_version push_back ( "Re_pv:PAW_LDA:11Feb1998"  )

◆ push_back() [1324/4950]

x species_pp_AUID push_back ( "598a3a038e3785b3"  )

◆ push_back() [1325/4950]

x vEATOM push_back ( 1509.  5757)

◆ push_back() [1326/4950]

x vTITEL push_back ( "PAWRh03Mar1998"  )

◆ push_back() [1327/4950]

x species_pp_version push_back ( "Rh:PAW_LDA:03Mar1998"  )

◆ push_back() [1328/4950]

x species_pp_AUID push_back ( "b03cdc726a115d0b"  )

◆ push_back() [1329/4950]

x vEATOM push_back ( 618.  414)

◆ push_back() [1330/4950]

x vTITEL push_back ( "PAWRh_pv17Apr2000"  )

◆ push_back() [1331/4950]

x species_pp push_back ( "Rh_pv"  )

◆ push_back() [1332/4950]

x species_pp_version push_back ( "Rh_pv:PAW_LDA:17Apr2000"  )

◆ push_back() [1333/4950]

x species_pp_AUID push_back ( "c6d7ff86b44b5d4c"  )

◆ push_back() [1334/4950]

x vEATOM push_back ( 2230.  4667)

◆ push_back() [1335/4950]

x vTITEL push_back ( "PAWRu17Apr2000"  )

◆ push_back() [1336/4950]

x species_pp_version push_back ( "Ru:PAW_LDA:17Apr2000"  )

◆ push_back() [1337/4950]

x species_pp_AUID push_back ( "64d0c8f1c723d0dc"  )

◆ push_back() [1338/4950]

x vEATOM push_back ( 456.  6552)

◆ push_back() [1339/4950]

x vTITEL push_back ( "PAWRu_pv03Mar1998"  )

◆ push_back() [1340/4950]

x species_pp push_back ( "Ru_pv"  )

◆ push_back() [1341/4950]

x species_pp_version push_back ( "Ru_pv:PAW_LDA:03Mar1998"  )

◆ push_back() [1342/4950]

x species_pp_AUID push_back ( "04267bcea324606c"  )

◆ push_back() [1343/4950]

x vEATOM push_back ( 1877.  2411)

◆ push_back() [1344/4950]

x vTITEL push_back ( "PAWSb04Feb1998"  )

◆ push_back() [1345/4950]

x species_pp_version push_back ( "Sb:PAW_LDA:04Feb1998"  )

◆ push_back() [1346/4950]

x species_pp_AUID push_back ( "b60fa981fd9b2d79"  )

◆ push_back() [1347/4950]

x species_pp_groundstate_structure push_back ( "N/A_b60fa981fd9b2d79"  )

◆ push_back() [1348/4950]

x vEATOM push_back ( 151.  6929)

◆ push_back() [1349/4950]

x vTITEL push_back ( "PAWSc_sv07Sep2000"  )

◆ push_back() [1350/4950]

x species_pp push_back ( "Sc_sv"  )

◆ push_back() [1351/4950]

x species_pp_version push_back ( "Sc_sv:PAW_LDA:07Sep2000"  )

◆ push_back() [1352/4950]

x species_pp_AUID push_back ( "dd64f21bfc2e4cab"  )

◆ push_back() [1353/4950]

x vEATOM push_back ( 1273.  9756)

◆ push_back() [1354/4950]

x vTITEL push_back ( "PAWSe03Mar1998"  )

◆ push_back() [1355/4950]

x species_pp_version push_back ( "Se:PAW_LDA:03Mar1998"  )

◆ push_back() [1356/4950]

x species_pp_AUID push_back ( "1c7e991bfae7e194"  )

◆ push_back() [1357/4950]

x species_pp_groundstate_structure push_back ( "N/A_1c7e991bfae7e194"  )

◆ push_back() [1358/4950]

x vTITEL push_back ( "PAWS_h21Jan2003"  )

◆ push_back() [1359/4950]

x species_pp push_back ( "S_h"  )

◆ push_back() [1360/4950]

x species_pp_version push_back ( "S_h:PAW_LDA:21Jan2003"  )

◆ push_back() [1361/4950]

x species_pp_AUID push_back ( "c286964f76cdc30b"  )

◆ push_back() [1362/4950]

x species_pp_groundstate_structure push_back ( "N/A_c286964f76cdc30b"  )

◆ push_back() [1363/4950]

x vEATOM push_back ( 277.  3745)

◆ push_back() [1364/4950]

x vTITEL push_back ( "PAWSi_h21Jan2003"  )

◆ push_back() [1365/4950]

x species_pp push_back ( "Si_h"  )

◆ push_back() [1366/4950]

x species_pp_version push_back ( "Si_h:PAW_LDA:21Jan2003"  )

◆ push_back() [1367/4950]

x species_pp_AUID push_back ( "940bc6e41f3ea1ba"  )

◆ push_back() [1368/4950]

x vEATOM push_back ( 103.  4324)

◆ push_back() [1369/4950]

x vTITEL push_back ( "PAWSi02Apr1999"  )

◆ push_back() [1370/4950]

x species_pp_version push_back ( "Si:PAW_LDA:02Apr1999"  )

◆ push_back() [1371/4950]

x species_pp_AUID push_back ( "2e636f3ea3dd411d"  )

◆ push_back() [1372/4950]

x vTITEL push_back ( "PAWSn_d09Feb1998"  )

◆ push_back() [1373/4950]

x species_pp_version push_back ( "Sn_d:PAW_LDA:09Feb1998"  )

◆ push_back() [1374/4950]

x species_pp_AUID push_back ( "dbbb37ac47b7e985"  )

◆ push_back() [1375/4950]

x species_pp_groundstate_structure push_back ( "N/A_dbbb37ac47b7e985"  )

◆ push_back() [1376/4950]

x vEATOM push_back ( 1896.  7356)

◆ push_back() [1377/4950]

x vTITEL push_back ( "PAWSn03Oct2001"  )

◆ push_back() [1378/4950]

x species_pp_version push_back ( "Sn:PAW_LDA:03Oct2001"  )

◆ push_back() [1379/4950]

x species_pp_AUID push_back ( "fd15d64a598eca97"  )

◆ push_back() [1380/4950]

x species_pp_groundstate_structure push_back ( "N/A_fd15d64a598eca97"  )

◆ push_back() [1381/4950]

x vEATOM push_back ( 95.  4765)

◆ push_back() [1382/4950]

x vTITEL push_back ( "PAWS21Jan2003"  )

◆ push_back() [1383/4950]

x species_pp_version push_back ( "S:PAW_LDA:21Jan2003"  )

◆ push_back() [1384/4950]

x species_pp_AUID push_back ( "599cdacbb1833f71"  )

◆ push_back() [1385/4950]

x species_pp_groundstate_structure push_back ( "N/A_599cdacbb1833f71"  )

◆ push_back() [1386/4950]

x vTITEL push_back ( "PAWSr_sv10Feb1998"  )

◆ push_back() [1387/4950]

x species_pp push_back ( "Sr_sv"  )

◆ push_back() [1388/4950]

x species_pp_version push_back ( "Sr_sv:PAW_LDA:10Feb1998"  )

◆ push_back() [1389/4950]

x species_pp_AUID push_back ( "3951da71de7f3413"  )

◆ push_back() [1390/4950]

x vEATOM push_back ( 845.  6099)

◆ push_back() [1391/4950]

x vTITEL push_back ( "PAWTa21Jan2003"  )

◆ push_back() [1392/4950]

x species_pp_version push_back ( "Ta:PAW_LDA:21Jan2003"  )

◆ push_back() [1393/4950]

x species_pp_AUID push_back ( "d1561ec02d179810"  )

◆ push_back() [1394/4950]

x vEATOM push_back ( 132.  2259)

◆ push_back() [1395/4950]

x vTITEL push_back ( "PAWTa_pv07Sep2000"  )

◆ push_back() [1396/4950]

x species_pp push_back ( "Ta_pv"  )

◆ push_back() [1397/4950]

x species_pp_version push_back ( "Ta_pv:PAW_LDA:07Sep2000"  )

◆ push_back() [1398/4950]

x species_pp_AUID push_back ( "6d000fcf1ccde6da"  )

◆ push_back() [1399/4950]

x vEATOM push_back ( 1050.  5285)

◆ push_back() [1400/4950]

x vTITEL push_back ( "PAWTc21Jan2003"  )

◆ push_back() [1401/4950]

x species_pp_version push_back ( "Tc:PAW_LDA:21Jan2003"  )

◆ push_back() [1402/4950]

x species_pp_AUID push_back ( "43f93be60f147933"  )

◆ push_back() [1403/4950]

x vEATOM push_back ( 324.  2816)

◆ push_back() [1404/4950]

x vTITEL push_back ( "PAWTc_pv03Mar1998"  )

◆ push_back() [1405/4950]

x species_pp push_back ( "Tc_pv"  )

◆ push_back() [1406/4950]

x species_pp_version push_back ( "Tc_pv:PAW_LDA:03Mar1998"  )

◆ push_back() [1407/4950]

x species_pp_AUID push_back ( "aaf18f3b4fa31411"  )

◆ push_back() [1408/4950]

x vEATOM push_back ( 1563.  734)

◆ push_back() [1409/4950]

x vTITEL push_back ( "PAWTe03Oct2001"  )

◆ push_back() [1410/4950]

x species_pp_version push_back ( "Te:PAW_LDA:03Oct2001"  )

◆ push_back() [1411/4950]

x species_pp_AUID push_back ( "7513d4db67c0ec9e"  )

◆ push_back() [1412/4950]

x species_pp_groundstate_structure push_back ( "N/A_7513d4db67c0ec9e"  )

◆ push_back() [1413/4950]

x vEATOM push_back ( 225.  3402)

◆ push_back() [1414/4950]

x vTITEL push_back ( "PAWTh17Apr2000"  )

◆ push_back() [1415/4950]

x species push_back ( "Th"  )

◆ push_back() [1416/4950]

x species_Z push_back ( 90  )

◆ push_back() [1417/4950]

x species_pp_version push_back ( "Th:PAW_LDA:17Apr2000"  )

◆ push_back() [1418/4950]

x species_pp_AUID push_back ( "dadeb4fe1d563f09"  )

◆ push_back() [1419/4950]

x species_pp_groundstate_structure push_back ( "N/A_dadeb4fe1d563f09"  )

◆ push_back() [1420/4950]

x vEATOM push_back ( 988.  4509)

◆ push_back() [1421/4950]

x vTITEL push_back ( "PAWTh_s04May2000"  )

◆ push_back() [1422/4950]

x species_pp push_back ( "Th_s"  )

◆ push_back() [1423/4950]

x species_pp_version push_back ( "Th_s:PAW_LDA:04May2000"  )

◆ push_back() [1424/4950]

x species_pp_AUID push_back ( "0e35e9c61ab95ff4"  )

◆ push_back() [1425/4950]

x species_pp_groundstate_structure push_back ( "N/A_0e35e9c61ab95ff4"  )

◆ push_back() [1426/4950]

x vEATOM push_back ( 633.  6793)

◆ push_back() [1427/4950]

x vTITEL push_back ( "PAWTi03Oct2001"  )

◆ push_back() [1428/4950]

x species_pp_version push_back ( "Ti:PAW_LDA:03Oct2001"  )

◆ push_back() [1429/4950]

x species_pp_AUID push_back ( "264e8b27aa49e864"  )

◆ push_back() [1430/4950]

x vTITEL push_back ( "PAWTi_pv07Sep2000"  )

◆ push_back() [1431/4950]

x species_pp push_back ( "Ti_pv"  )

◆ push_back() [1432/4950]

x species_pp_version push_back ( "Ti_pv:PAW_LDA:07Sep2000"  )

◆ push_back() [1433/4950]

x species_pp_AUID push_back ( "567ef720cface091"  )

◆ push_back() [1434/4950]

x vEATOM push_back ( 1044.  4404)

◆ push_back() [1435/4950]

x vTITEL push_back ( "PAWTi_sv07Sep2000"  )

◆ push_back() [1436/4950]

x species_pp push_back ( "Ti_sv"  )

◆ push_back() [1437/4950]

x species_pp_version push_back ( "Ti_sv:PAW_LDA:07Sep2000"  )

◆ push_back() [1438/4950]

x species_pp_AUID push_back ( "5b9d5db647f6fc85"  )

◆ push_back() [1439/4950]

x vEATOM push_back ( 1588.  8698)

◆ push_back() [1440/4950]

x vTITEL push_back ( "PAWTl_d11Feb1998"  )

◆ push_back() [1441/4950]

x species_pp_version push_back ( "Tl_d:PAW_LDA:11Feb1998"  )

◆ push_back() [1442/4950]

x species_pp_AUID push_back ( "1a0488ce9d93df98"  )

◆ push_back() [1443/4950]

x vTITEL push_back ( "PAWTl03Oct2001"  )

◆ push_back() [1444/4950]

x species_pp_version push_back ( "Tl:PAW_LDA:03Oct2001"  )

◆ push_back() [1445/4950]

x species_pp_AUID push_back ( "2ad3380a31e82af9"  )

◆ push_back() [1446/4950]

x vEATOM push_back ( 58.  5111)

◆ push_back() [1447/4950]

x vTITEL push_back ( "PAWU17Apr2000"  )

◆ push_back() [1448/4950]

x species push_back ( "U"  )

◆ push_back() [1449/4950]

x species_Z push_back ( 92  )

◆ push_back() [1450/4950]

x species_pp_version push_back ( "U:PAW_LDA:17Apr2000"  )

◆ push_back() [1451/4950]

x species_pp_AUID push_back ( "63b9e5910b81edb0"  )

◆ push_back() [1452/4950]

x species_pp_groundstate_structure push_back ( "N/A_63b9e5910b81edb0"  )

◆ push_back() [1453/4950]

x vEATOM push_back ( 1409.  7225)

◆ push_back() [1454/4950]

x vTITEL push_back ( "PAWU_s04May2000"  )

◆ push_back() [1455/4950]

x species_pp push_back ( "U_s"  )

◆ push_back() [1456/4950]

x species_pp_version push_back ( "U_s:PAW_LDA:04May2000"  )

◆ push_back() [1457/4950]

x species_pp_AUID push_back ( "fe026c6b2fe2f9ca"  )

◆ push_back() [1458/4950]

x species_pp_groundstate_structure push_back ( "N/A_fe026c6b2fe2f9ca"  )

◆ push_back() [1459/4950]

x vTITEL push_back ( "PAWV07Aug2001"  )

◆ push_back() [1460/4950]

x species_pp_version push_back ( "V:PAW_LDA:07Aug2001"  )

◆ push_back() [1461/4950]

x species_pp_AUID push_back ( "a741261c8d2045c9"  )

◆ push_back() [1462/4950]

x vEATOM push_back ( 172.  452)

◆ push_back() [1463/4950]

x vTITEL push_back ( "PAWV_pv07Sep2000"  )

◆ push_back() [1464/4950]

x species_pp push_back ( "V_pv"  )

◆ push_back() [1465/4950]

x species_pp_version push_back ( "V_pv:PAW_LDA:07Sep2000"  )

◆ push_back() [1466/4950]

x species_pp_AUID push_back ( "0725afc42e47381e"  )

◆ push_back() [1467/4950]

x vEATOM push_back ( 1323.  7734)

◆ push_back() [1468/4950]

x vTITEL push_back ( "PAWV_sv07Sep2000"  )

◆ push_back() [1469/4950]

x species_pp push_back ( "V_sv"  )

◆ push_back() [1470/4950]

x species_pp_version push_back ( "V_sv:PAW_LDA:07Sep2000"  )

◆ push_back() [1471/4950]

x species_pp_AUID push_back ( "c3b5d34259b9b5f9"  )

◆ push_back() [1472/4950]

x vEATOM push_back ( 1952.  9739)

◆ push_back() [1473/4950]

x vTITEL push_back ( "PAWW19Jan2001"  )

◆ push_back() [1474/4950]

x species_pp_version push_back ( "W:PAW_LDA:19Jan2001"  )

◆ push_back() [1475/4950]

x species_pp_AUID push_back ( "6a5db51b820aa7a5"  )

◆ push_back() [1476/4950]

x vEATOM push_back ( 206.  537)

◆ push_back() [1477/4950]

x vTITEL push_back ( "PAWW_pv22Jul1998"  )

◆ push_back() [1478/4950]

x species_pp push_back ( "W_pv"  )

◆ push_back() [1479/4950]

x species_pp_version push_back ( "W_pv:PAW_LDA:22Jul1998"  )

◆ push_back() [1480/4950]

x species_pp_AUID push_back ( "e05803166f7d0e3e"  )

◆ push_back() [1481/4950]

x vEATOM push_back ( 1265.  3862)

◆ push_back() [1482/4950]

x vTITEL push_back ( "PAWXe07Sep2000"  )

◆ push_back() [1483/4950]

x species_pp_version push_back ( "Xe:PAW_LDA:07Sep2000"  )

◆ push_back() [1484/4950]

x species_pp_AUID push_back ( "de9fcc4ff04ee1a7"  )

◆ push_back() [1485/4950]

x species_pp_groundstate_structure push_back ( "N/A_de9fcc4ff04ee1a7"  )

◆ push_back() [1486/4950]

x vEATOM push_back ( 432.  1699)

◆ push_back() [1487/4950]

x vTITEL push_back ( "PAWY_sv10Feb1998"  )

◆ push_back() [1488/4950]

x species_pp push_back ( "Y_sv"  )

◆ push_back() [1489/4950]

x species_pp_version push_back ( "Y_sv:PAW_LDA:10Feb1998"  )

◆ push_back() [1490/4950]

x species_pp_AUID push_back ( "1844bc40a30b31c7"  )

◆ push_back() [1491/4950]

x vEATOM push_back ( 1049.  7514)

◆ push_back() [1492/4950]

x vTITEL push_back ( "PAWZn03Mar1998"  )

◆ push_back() [1493/4950]

x species_pp_version push_back ( "Zn:PAW_LDA:03Mar1998"  )

◆ push_back() [1494/4950]

x species_pp_AUID push_back ( "4b8b99f638e1a173"  )

◆ push_back() [1495/4950]

x vEATOM push_back ( 1754.  056)

◆ push_back() [1496/4950]

x vTITEL push_back ( "PAWZr_sv10Feb1998"  )

◆ push_back() [1497/4950]

x species_pp push_back ( "Zr_sv"  )

◆ push_back() [1498/4950]

x species_pp_version push_back ( "Zr_sv:PAW_LDA:10Feb1998"  )

◆ push_back() [1499/4950]

x species_pp_AUID push_back ( "844977898c624f61"  )

◆ push_back() [1500/4950]

x vTITEL push_back ( "PAW_GGAAc11Apr2000"  )

◆ push_back() [1501/4950]

x species_pp_version push_back ( "Ac:PAW_GGA:11Apr2000"  )

◆ push_back() [1502/4950]

x species_pp_AUID push_back ( "f04c8b0982efae26"  )

◆ push_back() [1503/4950]

x vEATOM push_back ( 813.  5384)

◆ push_back() [1504/4950]

x vTITEL push_back ( "PAW_GGAAc_s11Apr2000"  )

◆ push_back() [1505/4950]

x species_pp_version push_back ( "Ac_s:PAW_GGA:11Apr2000"  )

◆ push_back() [1506/4950]

x species_pp_AUID push_back ( "b5bf833f40cc220c"  )

◆ push_back() [1507/4950]

x vEATOM push_back ( 501.  7333)

◆ push_back() [1508/4950]

x vTITEL push_back ( "PAW_GGAAg18Jul2000"  )

◆ push_back() [1509/4950]

x species_pp_version push_back ( "Ag:PAW_GGA:18Jul2000"  )

◆ push_back() [1510/4950]

x species_pp_AUID push_back ( "dc0f72d3f1bd620d"  )

◆ push_back() [1511/4950]

x vEATOM push_back ( 1038.  4392)

◆ push_back() [1512/4950]

x species_pp_AUID push_back ( "4fe9cd6a4bbde118"  )

◆ push_back() [1513/4950]

x species_pp_groundstate_structure push_back ( "N/A_4fe9cd6a4bbde118"  )

◆ push_back() [1514/4950]

x vTITEL push_back ( "PAW_GGAAl05Jan2001"  )

◆ push_back() [1515/4950]

x species_pp_version push_back ( "Al:PAW_GGA:05Jan2001"  )

◆ push_back() [1516/4950]

x species_pp_AUID push_back ( "f2de0641bce99445"  )

◆ push_back() [1517/4950]

x vTITEL push_back ( "PAW_GGAAr06Sep2000"  )

◆ push_back() [1518/4950]

x species_pp_version push_back ( "Ar:PAW_GGA:06Sep2000"  )

◆ push_back() [1519/4950]

x species_pp_AUID push_back ( "5adcf9fd506a6f8f"  )

◆ push_back() [1520/4950]

x vTITEL push_back ( "PAW_GGAAs18Jul2000"  )

◆ push_back() [1521/4950]

x species_pp_version push_back ( "As:PAW_GGA:18Jul2000"  )

◆ push_back() [1522/4950]

x species_pp_AUID push_back ( "74beaf3de3ede98f"  )

◆ push_back() [1523/4950]

x species_pp_groundstate_structure push_back ( "N/A_74beaf3de3ede98f"  )

◆ push_back() [1524/4950]

x vEATOM push_back ( 170.  5562)

◆ push_back() [1525/4950]

x vTITEL push_back ( "PAW_GGAAu18Jul2000"  )

◆ push_back() [1526/4950]

x species_pp_version push_back ( "Au:PAW_GGA:18Jul2000"  )

◆ push_back() [1527/4950]

x species_pp_AUID push_back ( "57972e71335a410c"  )

◆ push_back() [1528/4950]

x vTITEL push_back ( "PAW_GGABa_sv14Apr2000"  )

◆ push_back() [1529/4950]

x species_pp_version push_back ( "Ba_sv:PAW_GGA:14Apr2000"  )

◆ push_back() [1530/4950]

x species_pp_AUID push_back ( "0ea886f29a8f18e6"  )

◆ push_back() [1531/4950]

x vEATOM push_back ( 701.  3292)

◆ push_back() [1532/4950]

x vTITEL push_back ( "PAW_GGABe11Feb1998"  )

◆ push_back() [1533/4950]

x species_pp_version push_back ( "Be:PAW_GGA:11Feb1998"  )

◆ push_back() [1534/4950]

x species_pp_AUID push_back ( "362b70d9e55ede03"  )

◆ push_back() [1535/4950]

x vTITEL push_back ( "PAW_GGABe_sv23Feb1998"  )

◆ push_back() [1536/4950]

x species_pp_version push_back ( "Be_sv:PAW_GGA:23Feb1998"  )

◆ push_back() [1537/4950]

x species_pp_AUID push_back ( "06db0a6447fa3259"  )

◆ push_back() [1538/4950]

x species_pp_groundstate_structure push_back ( "N/A_06db0a6447fa3259"  )

◆ push_back() [1539/4950]

x vEATOM push_back ( 398.  5751)

◆ push_back() [1540/4950]

x vTITEL push_back ( "PAW_GGAB_h18Jul2000"  )

◆ push_back() [1541/4950]

x species_pp_version push_back ( "B_h:PAW_GGA:18Jul2000"  )

◆ push_back() [1542/4950]

x species_pp_AUID push_back ( "00b4dfcc28b5887b"  )

◆ push_back() [1543/4950]

x vEATOM push_back ( 71.  3643)

◆ push_back() [1544/4950]

x vTITEL push_back ( "PAW_GGABi_d10Feb1998"  )

◆ push_back() [1545/4950]

x species_pp_version push_back ( "Bi_d:PAW_GGA:10Feb1998"  )

◆ push_back() [1546/4950]

x species_pp_AUID push_back ( "7fb1d770e0563c39"  )

◆ push_back() [1547/4950]

x species_pp_groundstate_structure push_back ( "N/A_7fb1d770e0563c39"  )

◆ push_back() [1548/4950]

x vEATOM push_back ( 1960.  2694)

◆ push_back() [1549/4950]

x vTITEL push_back ( "PAW_GGABi30Jul2001"  )

◆ push_back() [1550/4950]

x species_pp_version push_back ( "Bi:PAW_GGA:30Jul2001"  )

◆ push_back() [1551/4950]

x species_pp_AUID push_back ( "f7b2601e76af1b57"  )

◆ push_back() [1552/4950]

x species_pp_groundstate_structure push_back ( "N/A_f7b2601e76af1b57"  )

◆ push_back() [1553/4950]

x vEATOM push_back ( 150.  9981)

◆ push_back() [1554/4950]

x vTITEL push_back ( "PAW_GGAB18Jul2000"  )

◆ push_back() [1555/4950]

x species_pp_version push_back ( "B:PAW_GGA:18Jul2000"  )

◆ push_back() [1556/4950]

x species_pp_AUID push_back ( "525669d5791f42d1"  )

◆ push_back() [1557/4950]

x species_pp_groundstate_structure push_back ( "N/A_525669d5791f42d1"  )

◆ push_back() [1558/4950]

x vTITEL push_back ( "PAW_GGABr04May1998"  )

◆ push_back() [1559/4950]

x species_pp_version push_back ( "Br:PAW_GGA:04May1998"  )

◆ push_back() [1560/4950]

x species_pp_AUID push_back ( "0bc9c739e7b39051"  )

◆ push_back() [1561/4950]

x species_pp_groundstate_structure push_back ( "N/A_0bc9c739e7b39051"  )

◆ push_back() [1562/4950]

x vEATOM push_back ( 368.  9861)

◆ push_back() [1563/4950]

x vTITEL push_back ( "PAW_GGAB_s21Dec2000"  )

◆ push_back() [1564/4950]

x species_pp_version push_back ( "B_s:PAW_GGA:21Dec2000"  )

◆ push_back() [1565/4950]

x species_pp_AUID push_back ( "d9818b779286eba4"  )

◆ push_back() [1566/4950]

x species_pp_groundstate_structure push_back ( "N/A_d9818b779286eba4"  )

◆ push_back() [1567/4950]

x vTITEL push_back ( "PAW_GGACa10Feb1998"  )

◆ push_back() [1568/4950]

x species_pp_version push_back ( "Ca:PAW_GGA:10Feb1998"  )

◆ push_back() [1569/4950]

x species_pp_AUID push_back ( "7f030fc2723afab5"  )

◆ push_back() [1570/4950]

x vEATOM push_back ( 18.  2705)

◆ push_back() [1571/4950]

x vTITEL push_back ( "PAW_GGACa_pv05May1998"  )

◆ push_back() [1572/4950]

x species_pp_version push_back ( "Ca_pv:PAW_GGA:05May1998"  )

◆ push_back() [1573/4950]

x species_pp_AUID push_back ( "d0c3b753999f51e0"  )

◆ push_back() [1574/4950]

x vTITEL push_back ( "PAW_GGACa_sv04May1998"  )

◆ push_back() [1575/4950]

x species_pp_version push_back ( "Ca_sv:PAW_GGA:04May1998"  )

◆ push_back() [1576/4950]

x species_pp_AUID push_back ( "560b47e7f6be795e"  )

◆ push_back() [1577/4950]

x vTITEL push_back ( "PAW_GGACd04May1998"  )

◆ push_back() [1578/4950]

x species_pp_version push_back ( "Cd:PAW_GGA:04May1998"  )

◆ push_back() [1579/4950]

x species_pp_AUID push_back ( "0b0758f9de1eb816"  )

◆ push_back() [1580/4950]

x vEATOM push_back ( 1294.  4746)

◆ push_back() [1581/4950]

x vTITEL push_back ( "PAW_GGACe_311May2000"  )

◆ push_back() [1582/4950]

x species_pp push_back ( "Ce_3"  )

◆ push_back() [1583/4950]

x species_pp_version push_back ( "Ce_3:PAW_GGA:11May2000"  )

◆ push_back() [1584/4950]

x species_pp_AUID push_back ( "c30b547637edabc3"  )

◆ push_back() [1585/4950]

x vEATOM push_back ( 890.  6085)

◆ push_back() [1586/4950]

x vTITEL push_back ( "PAW_GGACe29Sep2000"  )

◆ push_back() [1587/4950]

x species_pp_version push_back ( "Ce:PAW_GGA:29Sep2000"  )

◆ push_back() [1588/4950]

x species_pp_AUID push_back ( "af507d55827ec15c"  )

◆ push_back() [1589/4950]

x vTITEL push_back ( "PAW_GGACe_s11May2000"  )

◆ push_back() [1590/4950]

x species_pp_version push_back ( "Ce_s:PAW_GGA:11May2000"  )

◆ push_back() [1591/4950]

x species_pp_AUID push_back ( "510a8ebc02942ebd"  )

◆ push_back() [1592/4950]

x vEATOM push_back ( 702.  7867)

◆ push_back() [1593/4950]

x vTITEL push_back ( "PAW_GGAC_h18Jul2000"  )

◆ push_back() [1594/4950]

x species_pp_version push_back ( "C_h:PAW_GGA:18Jul2000"  )

◆ push_back() [1595/4950]

x species_pp_AUID push_back ( "3a89016e2e639e47"  )

◆ push_back() [1596/4950]

x vEATOM push_back ( 147.  4688)

◆ push_back() [1597/4950]

x vTITEL push_back ( "PAW_GGACl_h08Apr2002"  )

◆ push_back() [1598/4950]

x species_pp_version push_back ( "Cl_h:PAW_GGA:08Apr2002"  )

◆ push_back() [1599/4950]

x species_pp_AUID push_back ( "1d3c17a82ce3af33"  )

◆ push_back() [1600/4950]

x species_pp_groundstate_structure push_back ( "N/A_1d3c17a82ce3af33"  )

◆ push_back() [1601/4950]

x vTITEL push_back ( "PAW_GGACl21Jan2003"  )

◆ push_back() [1602/4950]

x species_pp_version push_back ( "Cl:PAW_GGA:21Jan2003"  )

◆ push_back() [1603/4950]

x species_pp_AUID push_back ( "d215af2b6d50927c"  )

◆ push_back() [1604/4950]

x species_pp_groundstate_structure push_back ( "N/A_d215af2b6d50927c"  )

◆ push_back() [1605/4950]

x vTITEL push_back ( "PAW_GGACo03Mar1998"  )

◆ push_back() [1606/4950]

x species_pp_version push_back ( "Co:PAW_GGA:03Mar1998"  )

◆ push_back() [1607/4950]

x species_pp_AUID push_back ( "f3c42ce518194ac4"  )

◆ push_back() [1608/4950]

x vEATOM push_back ( 814.  8806)

◆ push_back() [1609/4950]

x vTITEL push_back ( "PAW_GGAC05Jan2001"  )

◆ push_back() [1610/4950]

x species_pp_version push_back ( "C:PAW_GGA:05Jan2001"  )

◆ push_back() [1611/4950]

x species_pp_AUID push_back ( "58ee909441d7673b"  )

◆ push_back() [1612/4950]

x vTITEL push_back ( "PAW_GGACr03Mar1998"  )

◆ push_back() [1613/4950]

x species_pp_version push_back ( "Cr:PAW_GGA:03Mar1998"  )

◆ push_back() [1614/4950]

x species_pp_AUID push_back ( "1365c4634d5c2ea1"  )

◆ push_back() [1615/4950]

x vTITEL push_back ( "PAW_GGACr_pv07Sep2000"  )

◆ push_back() [1616/4950]

x species_pp_version push_back ( "Cr_pv:PAW_GGA:07Sep2000"  )

◆ push_back() [1617/4950]

x species_pp_AUID push_back ( "caa6b9695b37b7c7"  )

◆ push_back() [1618/4950]

x vEATOM push_back ( 1649.  3918)

◆ push_back() [1619/4950]

x vTITEL push_back ( "PAW_GGAC_s08Oct1999"  )

◆ push_back() [1620/4950]

x species_pp_version push_back ( "C_s:PAW_GGA:08Oct1999"  )

◆ push_back() [1621/4950]

x species_pp_AUID push_back ( "97cfc186c185e847"  )

◆ push_back() [1622/4950]

x vTITEL push_back ( "PAW_GGACs_sv07Sep2000"  )

◆ push_back() [1623/4950]

x species_pp_version push_back ( "Cs_sv:PAW_GGA:07Sep2000"  )

◆ push_back() [1624/4950]

x species_pp_AUID push_back ( "8248540037be9eb8"  )

◆ push_back() [1625/4950]

x species_pp_groundstate_structure push_back ( "N/A_8248540037be9eb8"  )

◆ push_back() [1626/4950]

x vEATOM push_back ( 556.  1449)

◆ push_back() [1627/4950]

x vTITEL push_back ( "PAW_GGACu05Jan2001"  )

◆ push_back() [1628/4950]

x species_pp_version push_back ( "Cu:PAW_GGA:05Jan2001"  )

◆ push_back() [1629/4950]

x species_pp_AUID push_back ( "cd77b2d6e432ab5d"  )

◆ push_back() [1630/4950]

x vEATOM push_back ( 1393.  0707)

◆ push_back() [1631/4950]

x vTITEL push_back ( "PAW_GGACu_pv19Apr2000"  )

◆ push_back() [1632/4950]

x species_pp_version push_back ( "Cu_pv:PAW_GGA:19Apr2000"  )

◆ push_back() [1633/4950]

x species_pp_AUID push_back ( "a81d4798925d371d"  )

◆ push_back() [1634/4950]

x vEATOM push_back ( 4122.  6997)

◆ push_back() [1635/4950]

x vTITEL push_back ( "PAW_GGADy_310May2000"  )

◆ push_back() [1636/4950]

x species_pp push_back ( "Dy"  )

◆ push_back() [1637/4950]

x species_Z push_back ( 66  )

◆ push_back() [1638/4950]

x species_pp push_back ( "Dy_3"  )

◆ push_back() [1639/4950]

x species_pp_version push_back ( "Dy_3:PAW_GGA:10May2000"  )

◆ push_back() [1640/4950]

x species_pp_AUID push_back ( "57f7009ab6dbe961"  )

◆ push_back() [1641/4950]

x vEATOM push_back ( 652.  0337)

◆ push_back() [1642/4950]

x vTITEL push_back ( "PAW_GGAEr_310May2000"  )

◆ push_back() [1643/4950]

x species_pp push_back ( "Er"  )

◆ push_back() [1644/4950]

x species_Z push_back ( 68  )

◆ push_back() [1645/4950]

x species_pp push_back ( "Er_3"  )

◆ push_back() [1646/4950]

x species_pp_version push_back ( "Er_3:PAW_GGA:10May2000"  )

◆ push_back() [1647/4950]

x species_pp_AUID push_back ( "475773d1d750641c"  )

◆ push_back() [1648/4950]

x species_pp_groundstate_structure push_back ( "N/A_475773d1d750641c"  )

◆ push_back() [1649/4950]

x vEATOM push_back ( 672.  8481)

◆ push_back() [1650/4950]

x vTITEL push_back ( "PAW_GGAEu_210May2000"  )

◆ push_back() [1651/4950]

x species_pp push_back ( "Eu"  )

◆ push_back() [1652/4950]

x species_Z push_back ( 63  )

◆ push_back() [1653/4950]

x species_pp push_back ( "Eu_2"  )

◆ push_back() [1654/4950]

x species_pp_version push_back ( "Eu_2:PAW_GGA:10May2000"  )

◆ push_back() [1655/4950]

x species_pp_AUID push_back ( "ed304d2386222db8"  )

◆ push_back() [1656/4950]

x species_pp_groundstate_structure push_back ( "N/A_ed304d2386222db8"  )

◆ push_back() [1657/4950]

x vEATOM push_back ( 506.  901)

◆ push_back() [1658/4950]

x vTITEL push_back ( "PAW_GGAFe03Mar1998"  )

◆ push_back() [1659/4950]

x species_pp_version push_back ( "Fe:PAW_GGA:03Mar1998"  )

◆ push_back() [1660/4950]

x species_pp_AUID push_back ( "8a9cdad8b2fd617c"  )

◆ push_back() [1661/4950]

x vEATOM push_back ( 595.  5622)

◆ push_back() [1662/4950]

x vTITEL push_back ( "PAW_GGAFe_pv06May1998"  )

◆ push_back() [1663/4950]

x species_pp_version push_back ( "Fe_pv:PAW_GGA:06May1998"  )

◆ push_back() [1664/4950]

x species_pp_AUID push_back ( "8c4dfe9b38461b3c"  )

◆ push_back() [1665/4950]

x vEATOM push_back ( 2459.  3729)

◆ push_back() [1666/4950]

x vTITEL push_back ( "PAW_GGAFe_sv14Sep2000"  )

◆ push_back() [1667/4950]

x species_pp push_back ( "Fe_sv"  )

◆ push_back() [1668/4950]

x species_pp_version push_back ( "Fe_sv:PAW_GGA:14Sep2000"  )

◆ push_back() [1669/4950]

x species_pp_AUID push_back ( "46955a9bf291f348"  )

◆ push_back() [1670/4950]

x vEATOM push_back ( 3379.  2075)

◆ push_back() [1671/4950]

x vTITEL push_back ( "PAW_GGAF_h04May1998"  )

◆ push_back() [1672/4950]

x species_pp_version push_back ( "F_h:PAW_GGA:04May1998"  )

◆ push_back() [1673/4950]

x species_pp_AUID push_back ( "6b5b5861e3863295"  )

◆ push_back() [1674/4950]

x species_pp_groundstate_structure push_back ( "N/A_6b5b5861e3863295"  )

◆ push_back() [1675/4950]

x vEATOM push_back ( 660.  511)

◆ push_back() [1676/4950]

x vTITEL push_back ( "PAW_GGAF31May2000"  )

◆ push_back() [1677/4950]

x species_pp_version push_back ( "F:PAW_GGA:31May2000"  )

◆ push_back() [1678/4950]

x species_pp_AUID push_back ( "c66ef209bd61b98b"  )

◆ push_back() [1679/4950]

x species_pp_groundstate_structure push_back ( "N/A_c66ef209bd61b98b"  )

◆ push_back() [1680/4950]

x vTITEL push_back ( "PAW_GGAF_s04May1998"  )

◆ push_back() [1681/4950]

x species_pp_version push_back ( "F_s:PAW_GGA:04May1998"  )

◆ push_back() [1682/4950]

x species_pp_AUID push_back ( "731241fd3c8dd512"  )

◆ push_back() [1683/4950]

x species_pp_groundstate_structure push_back ( "N/A_731241fd3c8dd512"  )

◆ push_back() [1684/4950]

x vTITEL push_back ( "PAW_GGAGa_d04May1998"  )

◆ push_back() [1685/4950]

x species_pp_version push_back ( "Ga_d:PAW_GGA:04May1998"  )

◆ push_back() [1686/4950]

x species_pp_AUID push_back ( "3fd9ac759f953abe"  )

◆ push_back() [1687/4950]

x species_pp_groundstate_structure push_back ( "N/A_3fd9ac759f953abe"  )

◆ push_back() [1688/4950]

x vEATOM push_back ( 2151.  3997)

◆ push_back() [1689/4950]

x vTITEL push_back ( "PAW_RPBEGa_h09Apr2002"  )

◆ push_back() [1690/4950]

x species_pp_type push_back ( "PAW_RPBE"  )

◆ push_back() [1691/4950]

x species_pp_version push_back ( "Ga_h:PAW_RPBE:09Apr2002"  )

◆ push_back() [1692/4950]

x species_pp_AUID push_back ( "47e95a8d720b4f46"  )

◆ push_back() [1693/4950]

x species_pp_groundstate_structure push_back ( "A11"  )

◆ push_back() [1694/4950]

x vTITEL push_back ( "PAW_GGAGa01Aug2001"  )

◆ push_back() [1695/4950]

x species_pp_version push_back ( "Ga:PAW_GGA:01Aug2001"  )

◆ push_back() [1696/4950]

x species_pp_AUID push_back ( "f9e06e2e9dcc0bce"  )

◆ push_back() [1697/4950]

x species_pp_groundstate_structure push_back ( "N/A_f9e06e2e9dcc0bce"  )

◆ push_back() [1698/4950]

x vTITEL push_back ( "PAW_GGAGd_310May2000"  )

◆ push_back() [1699/4950]

x species_pp push_back ( "Gd"  )

◆ push_back() [1700/4950]

x species_Z push_back ( 64  )

◆ push_back() [1701/4950]

x species_pp push_back ( "Gd_3"  )

◆ push_back() [1702/4950]

x species_pp_version push_back ( "Gd_3:PAW_GGA:10May2000"  )

◆ push_back() [1703/4950]

x species_pp_AUID push_back ( "c7a5f64cebde588f"  )

◆ push_back() [1704/4950]

x species_pp_groundstate_structure push_back ( "N/A_c7a5f64cebde588f"  )

◆ push_back() [1705/4950]

x vTITEL push_back ( "PAW_GGAGe_d03Mar1998"  )

◆ push_back() [1706/4950]

x species_pp_version push_back ( "Ge_d:PAW_GGA:03Mar1998"  )

◆ push_back() [1707/4950]

x species_pp_AUID push_back ( "584c68479b3b04b1"  )

◆ push_back() [1708/4950]

x vEATOM push_back ( 2599.  052)

◆ push_back() [1709/4950]

x vTITEL push_back ( "PAW_RPBEGe_h09Apr2002"  )

◆ push_back() [1710/4950]

x species_pp_version push_back ( "Ge_h:PAW_RPBE:09Apr2002"  )

◆ push_back() [1711/4950]

x species_pp_AUID push_back ( "8f36ae9587237414"  )

◆ push_back() [1712/4950]

x vTITEL push_back ( "PAW_GGAGe25Jul2001"  )

◆ push_back() [1713/4950]

x species_pp_version push_back ( "Ge:PAW_GGA:25Jul2001"  )

◆ push_back() [1714/4950]

x species_pp_AUID push_back ( "4ab0dee23bce14c0"  )

◆ push_back() [1715/4950]

x species_pp_groundstate_structure push_back ( "N/A_4ab0dee23bce14c0"  )

◆ push_back() [1716/4950]

x vEATOM push_back ( 105.  2738)

◆ push_back() [1717/4950]

x vTITEL push_back ( "PAW_GGAH1.2516Feb2000"  )

◆ push_back() [1718/4950]

x species_pp_version push_back ( "H1.25:PAW_GGA:16Feb2000"  )

◆ push_back() [1719/4950]

x species_pp_AUID push_back ( "1ca3983e917c0911"  )

◆ push_back() [1720/4950]

x species_pp_groundstate_structure push_back ( "N/A_1ca3983e917c0911"  )

◆ push_back() [1721/4950]

x vEATOM push_back ( 22.  4029)

◆ push_back() [1722/4950]

x vTITEL push_back ( "PAW_GGAH1.507Sep2000"  )

◆ push_back() [1723/4950]

x species_pp_version push_back ( "H1.5:PAW_GGA:07Sep2000"  )

◆ push_back() [1724/4950]

x species_pp_AUID push_back ( "3a63892fa3058317"  )

◆ push_back() [1725/4950]

x species_pp_groundstate_structure push_back ( "N/A_3a63892fa3058317"  )

◆ push_back() [1726/4950]

x vEATOM push_back ( 36.  3143)

◆ push_back() [1727/4950]

x vTITEL push_back ( "PAW_GGAH.507Sep2000"  )

◆ push_back() [1728/4950]

x species_pp_version push_back ( "H.5:PAW_GGA:07Sep2000"  )

◆ push_back() [1729/4950]

x species_pp_AUID push_back ( "b734d4c8abeccdc1"  )

◆ push_back() [1730/4950]

x species_pp_groundstate_structure push_back ( "N/A_b734d4c8abeccdc1"  )

◆ push_back() [1731/4950]

x vTITEL push_back ( "PAW_GGAH.7516Feb2000"  )

◆ push_back() [1732/4950]

x species_pp_version push_back ( "H.75:PAW_GGA:16Feb2000"  )

◆ push_back() [1733/4950]

x species_pp_AUID push_back ( "b7a136e741a5e5ca"  )

◆ push_back() [1734/4950]

x species_pp_groundstate_structure push_back ( "N/A_b7a136e741a5e5ca"  )

◆ push_back() [1735/4950]

x vTITEL push_back ( "PAW_GGAHe05Jan2001"  )

◆ push_back() [1736/4950]

x species_pp_version push_back ( "He:PAW_GGA:05Jan2001"  )

◆ push_back() [1737/4950]

x species_pp_AUID push_back ( "c135275f4a0c77c9"  )

◆ push_back() [1738/4950]

x vRMAX push_back ( 0.  481074)

◆ push_back() [1739/4950]

x vEATOM push_back ( 78.  9078)

◆ push_back() [1740/4950]

x vTITEL push_back ( "PAW_GGAHf6May2002"  )

◆ push_back() [1741/4950]

x species_pp_version push_back ( "Hf:PAW_GGA:6May2002"  )

◆ push_back() [1742/4950]

x species_pp_AUID push_back ( "1703a3c3d5bdc240"  )

◆ push_back() [1743/4950]

x vEATOM push_back ( 76.  1993)

◆ push_back() [1744/4950]

x vTITEL push_back ( "PAW_GGAHf_pv17Apr2000"  )

◆ push_back() [1745/4950]

x species_pp_version push_back ( "Hf_pv:PAW_GGA:17Apr2000"  )

◆ push_back() [1746/4950]

x species_pp_AUID push_back ( "d56380d31571155d"  )

◆ push_back() [1747/4950]

x vEATOM push_back ( 860.  8447)

◆ push_back() [1748/4950]

x vTITEL push_back ( "PAW_GGAHg04May1998"  )

◆ push_back() [1749/4950]

x species_pp_version push_back ( "Hg:PAW_GGA:04May1998"  )

◆ push_back() [1750/4950]

x species_pp_AUID push_back ( "df9134b9ac23884a"  )

◆ push_back() [1751/4950]

x vEATOM push_back ( 1149.  548)

◆ push_back() [1752/4950]

x vTITEL push_back ( "PAW_GGAH_h04May1998"  )

◆ push_back() [1753/4950]

x species_pp_version push_back ( "H_h:PAW_GGA:04May1998"  )

◆ push_back() [1754/4950]

x species_pp_AUID push_back ( "ea1f7c49f797fcfa"  )

◆ push_back() [1755/4950]

x species_pp_groundstate_structure push_back ( "N/A_ea1f7c49f797fcfa"  )

◆ push_back() [1756/4950]

x vTITEL push_back ( "PAW_GGAHo_310May2000"  )

◆ push_back() [1757/4950]

x species_pp push_back ( "Ho"  )

◆ push_back() [1758/4950]

x species_Z push_back ( 67  )

◆ push_back() [1759/4950]

x species_pp push_back ( "Ho_3"  )

◆ push_back() [1760/4950]

x species_pp_version push_back ( "Ho_3:PAW_GGA:10May2000"  )

◆ push_back() [1761/4950]

x species_pp_AUID push_back ( "20bea66adf91e4a2"  )

◆ push_back() [1762/4950]

x vEATOM push_back ( 662.  4848)

◆ push_back() [1763/4950]

x vTITEL push_back ( "PAW_GGAH07Jul1998"  )

◆ push_back() [1764/4950]

x species_pp_version push_back ( "H:PAW_GGA:07Jul1998"  )

◆ push_back() [1765/4950]

x species_pp_AUID push_back ( "b95807e5b85c7d53"  )

◆ push_back() [1766/4950]

x species_pp_groundstate_structure push_back ( "N/A_b95807e5b85c7d53"  )

◆ push_back() [1767/4950]

x vTITEL push_back ( "PAW_GGAIn_d04May1998"  )

◆ push_back() [1768/4950]

x species_pp_version push_back ( "In_d:PAW_GGA:04May1998"  )

◆ push_back() [1769/4950]

x species_pp_AUID push_back ( "59971ca2f8e716cd"  )

◆ push_back() [1770/4950]

x species_pp_groundstate_structure push_back ( "N/A_59971ca2f8e716cd"  )

◆ push_back() [1771/4950]

x vEATOM push_back ( 1578.  245)

◆ push_back() [1772/4950]

x vTITEL push_back ( "PAW_GGAIn25Jul2001"  )

◆ push_back() [1773/4950]

x species_pp_version push_back ( "In:PAW_GGA:25Jul2001"  )

◆ push_back() [1774/4950]

x species_pp_AUID push_back ( "96c586b3406040f6"  )

◆ push_back() [1775/4950]

x species_pp_groundstate_structure push_back ( "N/A_96c586b3406040f6"  )

◆ push_back() [1776/4950]

x vTITEL push_back ( "PAW_GGAI07Sep2001"  )

◆ push_back() [1777/4950]

x species_pp_version push_back ( "I:PAW_GGA:07Sep2001"  )

◆ push_back() [1778/4950]

x species_pp_AUID push_back ( "1ccb5ec52177952e"  )

◆ push_back() [1779/4950]

x species_pp_groundstate_structure push_back ( "N/A_1ccb5ec52177952e"  )

◆ push_back() [1780/4950]

x vEATOM push_back ( 316.  3101)

◆ push_back() [1781/4950]

x vTITEL push_back ( "PAW_GGAIr04May1998"  )

◆ push_back() [1782/4950]

x species_pp_version push_back ( "Ir:PAW_GGA:04May1998"  )

◆ push_back() [1783/4950]

x species_pp_AUID push_back ( "b33a03214533a06a"  )

◆ push_back() [1784/4950]

x vEATOM push_back ( 561.  0228)

◆ push_back() [1785/4950]

x vTITEL push_back ( "PAW_GGAK_pv11Feb1998"  )

◆ push_back() [1786/4950]

x species_pp_version push_back ( "K_pv:PAW_GGA:11Feb1998"  )

◆ push_back() [1787/4950]

x species_pp_AUID push_back ( "90f35bb229eef165"  )

◆ push_back() [1788/4950]

x vTITEL push_back ( "PAW_GGAKr07Sep2000"  )

◆ push_back() [1789/4950]

x species_pp_version push_back ( "Kr:PAW_GGA:07Sep2000"  )

◆ push_back() [1790/4950]

x species_pp_AUID push_back ( "e928bdf2cccd491a"  )

◆ push_back() [1791/4950]

x species_pp_groundstate_structure push_back ( "N/A_e928bdf2cccd491a"  )

◆ push_back() [1792/4950]

x vEATOM push_back ( 507.  3202)

◆ push_back() [1793/4950]

x vTITEL push_back ( "PAW_GGAK_sv04May1998"  )

◆ push_back() [1794/4950]

x species_pp_version push_back ( "K_sv:PAW_GGA:04May1998"  )

◆ push_back() [1795/4950]

x species_pp_AUID push_back ( "5c717bdf563a1964"  )

◆ push_back() [1796/4950]

x vTITEL push_back ( "PAW_GGALa14Apr2000"  )

◆ push_back() [1797/4950]

x species_pp_version push_back ( "La:PAW_GGA:14Apr2000"  )

◆ push_back() [1798/4950]

x species_pp_AUID push_back ( "ec88cfb1842bf27d"  )

◆ push_back() [1799/4950]

x vTITEL push_back ( "PAW_GGALa_s17Apr2000"  )

◆ push_back() [1800/4950]

x species_pp_version push_back ( "La_s:PAW_GGA:17Apr2000"  )

◆ push_back() [1801/4950]

x species_pp_AUID push_back ( "b2abe18f66fcdafe"  )

◆ push_back() [1802/4950]

x vTITEL push_back ( "PAW_GGALi21Jan2003"  )

◆ push_back() [1803/4950]

x species_pp_version push_back ( "Li:PAW_GGA:21Jan2003"  )

◆ push_back() [1804/4950]

x species_pp_AUID push_back ( "0666c5aca67cb28d"  )

◆ push_back() [1805/4950]

x vTITEL push_back ( "PAW_GGALi_sv23Jan2001"  )

◆ push_back() [1806/4950]

x species_pp_version push_back ( "Li_sv:PAW_GGA:23Jan2001"  )

◆ push_back() [1807/4950]

x species_pp_AUID push_back ( "67021bad74ddb4c5"  )

◆ push_back() [1808/4950]

x vEATOM push_back ( 203.  0979)

◆ push_back() [1809/4950]

x vTITEL push_back ( "PAW_GGALu_310May2000"  )

◆ push_back() [1810/4950]

x species_pp push_back ( "Lu"  )

◆ push_back() [1811/4950]

x species_Z push_back ( 71  )

◆ push_back() [1812/4950]

x species_pp push_back ( "Lu_3"  )

◆ push_back() [1813/4950]

x species_pp_version push_back ( "Lu_3:PAW_GGA:10May2000"  )

◆ push_back() [1814/4950]

x species_pp_AUID push_back ( "60f7fcbf87dedc8f"  )

◆ push_back() [1815/4950]

x species_pp_groundstate_structure push_back ( "N/A_60f7fcbf87dedc8f"  )

◆ push_back() [1816/4950]

x vEATOM push_back ( 703.  6245)

◆ push_back() [1817/4950]

x vTITEL push_back ( "PAW_GGAMg05Jan2001"  )

◆ push_back() [1818/4950]

x species_pp_version push_back ( "Mg:PAW_GGA:05Jan2001"  )

◆ push_back() [1819/4950]

x species_pp_AUID push_back ( "de98b20ad5c678cf"  )

◆ push_back() [1820/4950]

x vTITEL push_back ( "PAW_GGAMg_pv10Feb1998"  )

◆ push_back() [1821/4950]

x species_pp_version push_back ( "Mg_pv:PAW_GGA:10Feb1998"  )

◆ push_back() [1822/4950]

x species_pp_AUID push_back ( "3e32a29daafd48c5"  )

◆ push_back() [1823/4950]

x vEATOM push_back ( 1058.  0899)

◆ push_back() [1824/4950]

x vTITEL push_back ( "PAW_GGAMn03Mar1998"  )

◆ push_back() [1825/4950]

x species_pp_version push_back ( "Mn:PAW_GGA:03Mar1998"  )

◆ push_back() [1826/4950]

x species_pp_AUID push_back ( "11dbafa135ac30f7"  )

◆ push_back() [1827/4950]

x species_pp_groundstate_structure push_back ( "N/A_11dbafa135ac30f7"  )

◆ push_back() [1828/4950]

x vTITEL push_back ( "PAW_GGAMn_pv07Sep2000"  )

◆ push_back() [1829/4950]

x species_pp_version push_back ( "Mn_pv:PAW_GGA:07Sep2000"  )

◆ push_back() [1830/4950]

x species_pp_AUID push_back ( "d7f8ff9c61a96a57"  )

◆ push_back() [1831/4950]

x species_pp_groundstate_structure push_back ( "N/A_d7f8ff9c61a96a57"  )

◆ push_back() [1832/4950]

x vEATOM push_back ( 2026.  9401)

◆ push_back() [1833/4950]

x vTITEL push_back ( "PAW_GGAMo08Jan2002"  )

◆ push_back() [1834/4950]

x species_pp_version push_back ( "Mo:PAW_GGA:08Jan2002"  )

◆ push_back() [1835/4950]

x species_pp_AUID push_back ( "4690ce5c08300f84"  )

◆ push_back() [1836/4950]

x vTITEL push_back ( "PAW_GGAMo_pv08Jan2002"  )

◆ push_back() [1837/4950]

x species_pp_version push_back ( "Mo_pv:PAW_GGA:08Jan2002"  )

◆ push_back() [1838/4950]

x species_pp_AUID push_back ( "173298095bee51b0"  )

◆ push_back() [1839/4950]

x vEATOM push_back ( 1285.  2825)

◆ push_back() [1840/4950]

x vTITEL push_back ( "PAW_GGANa05Jan2001"  )

◆ push_back() [1841/4950]

x species_pp_version push_back ( "Na:PAW_GGA:05Jan2001"  )

◆ push_back() [1842/4950]

x species_pp_AUID push_back ( "e7d71dba59886669"  )

◆ push_back() [1843/4950]

x vTITEL push_back ( "PAW_GGANa_pv05Jan2001"  )

◆ push_back() [1844/4950]

x species_pp_version push_back ( "Na_pv:PAW_GGA:05Jan2001"  )

◆ push_back() [1845/4950]

x species_pp_AUID push_back ( "f44fe5066a3bc573"  )

◆ push_back() [1846/4950]

x vEATOM push_back ( 767.  2135)

◆ push_back() [1847/4950]

x vTITEL push_back ( "PAW_GGANa_sv28Sep2000"  )

◆ push_back() [1848/4950]

x species_pp_version push_back ( "Na_sv:PAW_GGA:28Sep2000"  )

◆ push_back() [1849/4950]

x species_pp_AUID push_back ( "192d4f6f863806ad"  )

◆ push_back() [1850/4950]

x vEATOM push_back ( 1309.  1124)

◆ push_back() [1851/4950]

x vTITEL push_back ( "PAW_GGANb_pv09Jan2002"  )

◆ push_back() [1852/4950]

x species_pp_version push_back ( "Nb_pv:PAW_GGA:09Jan2002"  )

◆ push_back() [1853/4950]

x species_pp_AUID push_back ( "3df5731180246390"  )

◆ push_back() [1854/4950]

x vTITEL push_back ( "PAW_GGANb_sv14Nov2001"  )

◆ push_back() [1855/4950]

x species_pp_version push_back ( "Nb_sv:PAW_GGA:14Nov2001"  )

◆ push_back() [1856/4950]

x species_pp_AUID push_back ( "79b1b1f832ef1be0"  )

◆ push_back() [1857/4950]

x vEATOM push_back ( 1555.  9104)

◆ push_back() [1858/4950]

x vTITEL push_back ( "PAW_GGANd_311May2000"  )

◆ push_back() [1859/4950]

x species_pp push_back ( "Nd"  )

◆ push_back() [1860/4950]

x species_Z push_back ( 60  )

◆ push_back() [1861/4950]

x species_pp push_back ( "Nd_3"  )

◆ push_back() [1862/4950]

x species_pp_version push_back ( "Nd_3:PAW_GGA:11May2000"  )

◆ push_back() [1863/4950]

x species_pp_AUID push_back ( "0416668efb02e74e"  )

◆ push_back() [1864/4950]

x species_pp_groundstate_structure push_back ( "N/A_0416668efb02e74e"  )

◆ push_back() [1865/4950]

x vEATOM push_back ( 934.  1646)

◆ push_back() [1866/4950]

x vTITEL push_back ( "PAW_GGANe05Jan2001"  )

◆ push_back() [1867/4950]

x species_pp_version push_back ( "Ne:PAW_GGA:05Jan2001"  )

◆ push_back() [1868/4950]

x species_pp_AUID push_back ( "445c00adf152283d"  )

◆ push_back() [1869/4950]

x vEATOM push_back ( 956.  418)

◆ push_back() [1870/4950]

x vTITEL push_back ( "PAW_GGAN_h18Jul2000"  )

◆ push_back() [1871/4950]

x species_pp_version push_back ( "N_h:PAW_GGA:18Jul2000"  )

◆ push_back() [1872/4950]

x species_pp_AUID push_back ( "30ecf6078bcb05be"  )

◆ push_back() [1873/4950]

x species_pp_groundstate_structure push_back ( "N/A_30ecf6078bcb05be"  )

◆ push_back() [1874/4950]

x vEATOM push_back ( 265.  0126)

◆ push_back() [1875/4950]

x vTITEL push_back ( "PAW_GGANi03Mar1998"  )

◆ push_back() [1876/4950]

x species_pp_version push_back ( "Ni:PAW_GGA:03Mar1998"  )

◆ push_back() [1877/4950]

x species_pp_AUID push_back ( "f316c1e20cc629f5"  )

◆ push_back() [1878/4950]

x vEATOM push_back ( 1079.  4692)

◆ push_back() [1879/4950]

x vTITEL push_back ( "PAW_GGANi_pv19Apr2000"  )

◆ push_back() [1880/4950]

x species_pp_version push_back ( "Ni_pv:PAW_GGA:19Apr2000"  )

◆ push_back() [1881/4950]

x species_pp_AUID push_back ( "55fd1c17c8c96b19"  )

◆ push_back() [1882/4950]

x vEATOM push_back ( 3503.  498)

◆ push_back() [1883/4950]

x vTITEL push_back ( "PAW_GGAN31May2000"  )

◆ push_back() [1884/4950]

x species_pp_version push_back ( "N:PAW_GGA:31May2000"  )

◆ push_back() [1885/4950]

x species_pp_AUID push_back ( "a149441436bc0478"  )

◆ push_back() [1886/4950]

x species_pp_groundstate_structure push_back ( "N/A_a149441436bc0478"  )

◆ push_back() [1887/4950]

x vTITEL push_back ( "PAW_GGANp14Apr2000"  )

◆ push_back() [1888/4950]

x species_pp_version push_back ( "Np:PAW_GGA:14Apr2000"  )

◆ push_back() [1889/4950]

x species_pp_AUID push_back ( "713bfba4b4be7aa0"  )

◆ push_back() [1890/4950]

x species_pp_groundstate_structure push_back ( "N/A_713bfba4b4be7aa0"  )

◆ push_back() [1891/4950]

x vEATOM push_back ( 1661.  1827)

◆ push_back() [1892/4950]

x vTITEL push_back ( "PAW_GGANp_s04May2000"  )

◆ push_back() [1893/4950]

x species_pp_version push_back ( "Np_s:PAW_GGA:04May2000"  )

◆ push_back() [1894/4950]

x species_pp_AUID push_back ( "f08ef53958258009"  )

◆ push_back() [1895/4950]

x species_pp_groundstate_structure push_back ( "N/A_f08ef53958258009"  )

◆ push_back() [1896/4950]

x vTITEL push_back ( "PAW_GGAN_s04May1998"  )

◆ push_back() [1897/4950]

x species_pp_version push_back ( "N_s:PAW_GGA:04May1998"  )

◆ push_back() [1898/4950]

x species_pp_AUID push_back ( "5342b67a48172d80"  )

◆ push_back() [1899/4950]

x species_pp_groundstate_structure push_back ( "N/A_5342b67a48172d80"  )

◆ push_back() [1900/4950]

x vTITEL push_back ( "PAW_GGAO_h04May1998"  )

◆ push_back() [1901/4950]

x species_pp_version push_back ( "O_h:PAW_GGA:04May1998"  )

◆ push_back() [1902/4950]

x species_pp_AUID push_back ( "a5527b5f14b94c5a"  )

◆ push_back() [1903/4950]

x species_pp_groundstate_structure push_back ( "N/A_a5527b5f14b94c5a"  )

◆ push_back() [1904/4950]

x vEATOM push_back ( 433.  0277)

◆ push_back() [1905/4950]

x vTITEL push_back ( "PAW_GGAO05Jan2001"  )

◆ push_back() [1906/4950]

x species_pp_version push_back ( "O:PAW_GGA:05Jan2001"  )

◆ push_back() [1907/4950]

x species_pp_AUID push_back ( "3efe191e71ca4749"  )

◆ push_back() [1908/4950]

x species_pp_groundstate_structure push_back ( "N/A_3efe191e71ca4749"  )

◆ push_back() [1909/4950]

x vTITEL push_back ( "PAW_GGAO_s04May1998"  )

◆ push_back() [1910/4950]

x species_pp_version push_back ( "O_s:PAW_GGA:04May1998"  )

◆ push_back() [1911/4950]

x species_pp_AUID push_back ( "f405acd35b631841"  )

◆ push_back() [1912/4950]

x species_pp_groundstate_structure push_back ( "N/A_f405acd35b631841"  )

◆ push_back() [1913/4950]

x vTITEL push_back ( "PAW_GGAOs06Feb2003"  )

◆ push_back() [1914/4950]

x species_pp_version push_back ( "Os:PAW_GGA:06Feb2003"  )

◆ push_back() [1915/4950]

x species_pp_AUID push_back ( "4cdd79622cbed39c"  )

◆ push_back() [1916/4950]

x vTITEL push_back ( "PAW_GGAOs_pv10Feb1998"  )

◆ push_back() [1917/4950]

x species_pp_version push_back ( "Os_pv:PAW_GGA:10Feb1998"  )

◆ push_back() [1918/4950]

x species_pp_AUID push_back ( "d2665c78be0bcda4"  )

◆ push_back() [1919/4950]

x vEATOM push_back ( 1780.  1635)

◆ push_back() [1920/4950]

x vTITEL push_back ( "PAW_GGAPa14Apr2000"  )

◆ push_back() [1921/4950]

x species_pp_version push_back ( "Pa:PAW_GGA:14Apr2000"  )

◆ push_back() [1922/4950]

x species_pp_AUID push_back ( "765d0e3ec6b550ff"  )

◆ push_back() [1923/4950]

x species_pp_groundstate_structure push_back ( "N/A_765d0e3ec6b550ff"  )

◆ push_back() [1924/4950]

x vEATOM push_back ( 1180.  1349)

◆ push_back() [1925/4950]

x vTITEL push_back ( "PAW_GGAPa_s11Apr2000"  )

◆ push_back() [1926/4950]

x species_pp_version push_back ( "Pa_s:PAW_GGA:11Apr2000"  )

◆ push_back() [1927/4950]

x species_pp_AUID push_back ( "5bdf98fbcb0b6a9d"  )

◆ push_back() [1928/4950]

x species_pp_groundstate_structure push_back ( "N/A_5bdf98fbcb0b6a9d"  )

◆ push_back() [1929/4950]

x vEATOM push_back ( 781.  9719)

◆ push_back() [1930/4950]

x vTITEL push_back ( "PAW_GGAPb_d04May1998"  )

◆ push_back() [1931/4950]

x species_pp_version push_back ( "Pb_d:PAW_GGA:04May1998"  )

◆ push_back() [1932/4950]

x species_pp_AUID push_back ( "7d26482cab914656"  )

◆ push_back() [1933/4950]

x vEATOM push_back ( 1662.  6729)

◆ push_back() [1934/4950]

x vTITEL push_back ( "PAW_GGAPb25Jul2001"  )

◆ push_back() [1935/4950]

x species_pp_version push_back ( "Pb:PAW_GGA:25Jul2001"  )

◆ push_back() [1936/4950]

x species_pp_AUID push_back ( "9568f688bb71b2b0"  )

◆ push_back() [1937/4950]

x vEATOM push_back ( 97.  1361)

◆ push_back() [1938/4950]

x vTITEL push_back ( "PAW_GGAPd05Jan2001"  )

◆ push_back() [1939/4950]

x species_pp_version push_back ( "Pd:PAW_GGA:05Jan2001"  )

◆ push_back() [1940/4950]

x species_pp_AUID push_back ( "7e8d64cc173f9f0c"  )

◆ push_back() [1941/4950]

x vEATOM push_back ( 810.  7745)

◆ push_back() [1942/4950]

x vTITEL push_back ( "PAW_GGAPd_pv04Mar1998"  )

◆ push_back() [1943/4950]

x species_pp_version push_back ( "Pd_pv:PAW_GGA:04Mar1998"  )

◆ push_back() [1944/4950]

x species_pp_AUID push_back ( "46106d1a706186be"  )

◆ push_back() [1945/4950]

x vEATOM push_back ( 2622.  9167)

◆ push_back() [1946/4950]

x vTITEL push_back ( "PAW_GGAP_h08Apr2002"  )

◆ push_back() [1947/4950]

x species_pp_version push_back ( "P_h:PAW_GGA:08Apr2002"  )

◆ push_back() [1948/4950]

x species_pp_AUID push_back ( "975fec91ca7d72ff"  )

◆ push_back() [1949/4950]

x species_pp_groundstate_structure push_back ( "N/A_975fec91ca7d72ff"  )

◆ push_back() [1950/4950]

x vTITEL push_back ( "PAW_GGAPm_311May2000"  )

◆ push_back() [1951/4950]

x species_pp push_back ( "Pm"  )

◆ push_back() [1952/4950]

x species_Z push_back ( 61  )

◆ push_back() [1953/4950]

x species_pp push_back ( "Pm_3"  )

◆ push_back() [1954/4950]

x species_pp_version push_back ( "Pm_3:PAW_GGA:11May2000"  )

◆ push_back() [1955/4950]

x species_pp_AUID push_back ( "c79d276a0c376048"  )

◆ push_back() [1956/4950]

x species_pp_groundstate_structure push_back ( "N/A_c79d276a0c376048"  )

◆ push_back() [1957/4950]

x vEATOM push_back ( 954.  5657)

◆ push_back() [1958/4950]

x vTITEL push_back ( "PAW_GGAP21Jan2003"  )

◆ push_back() [1959/4950]

x species_pp_version push_back ( "P:PAW_GGA:21Jan2003"  )

◆ push_back() [1960/4950]

x species_pp_AUID push_back ( "45ac3d6f0ea805a5"  )

◆ push_back() [1961/4950]

x species_pp_groundstate_structure push_back ( "N/A_45ac3d6f0ea805a5"  )

◆ push_back() [1962/4950]

x vTITEL push_back ( "PAW_GGAPr_325Sep2001"  )

◆ push_back() [1963/4950]

x species_pp push_back ( "Pr"  )

◆ push_back() [1964/4950]

x species_Z push_back ( 59  )

◆ push_back() [1965/4950]

x species_pp push_back ( "Pr_3"  )

◆ push_back() [1966/4950]

x species_pp_version push_back ( "Pr_3:PAW_GGA:25Sep2001"  )

◆ push_back() [1967/4950]

x species_pp_AUID push_back ( "d5a5630d0673a343"  )

◆ push_back() [1968/4950]

x species_pp_groundstate_structure push_back ( "N/A_d5a5630d0673a343"  )

◆ push_back() [1969/4950]

x vEATOM push_back ( 912.  9099)

◆ push_back() [1970/4950]

x vTITEL push_back ( "PAW_GGAPt05Jan2001"  )

◆ push_back() [1971/4950]

x species_pp_version push_back ( "Pt:PAW_GGA:05Jan2001"  )

◆ push_back() [1972/4950]

x species_pp_AUID push_back ( "05e3fa0ef96c01d7"  )

◆ push_back() [1973/4950]

x vEATOM push_back ( 730.  0441)

◆ push_back() [1974/4950]

x vTITEL push_back ( "PAW_GGAPu14Apr2000"  )

◆ push_back() [1975/4950]

x species_pp_version push_back ( "Pu:PAW_GGA:14Apr2000"  )

◆ push_back() [1976/4950]

x species_pp_AUID push_back ( "98637714bfd583be"  )

◆ push_back() [1977/4950]

x species_pp_groundstate_structure push_back ( "N/A_98637714bfd583be"  )

◆ push_back() [1978/4950]

x vEATOM push_back ( 1948.  9676)

◆ push_back() [1979/4950]

x vTITEL push_back ( "PAW_GGAPu_s04May2000"  )

◆ push_back() [1980/4950]

x species_pp_version push_back ( "Pu_s:PAW_GGA:04May2000"  )

◆ push_back() [1981/4950]

x species_pp_AUID push_back ( "4ab0da56e5d35bee"  )

◆ push_back() [1982/4950]

x species_pp_groundstate_structure push_back ( "N/A_4ab0da56e5d35bee"  )

◆ push_back() [1983/4950]

x vTITEL push_back ( "PAW_GGARb_pv11Feb1998"  )

◆ push_back() [1984/4950]

x species_pp_version push_back ( "Rb_pv:PAW_GGA:11Feb1998"  )

◆ push_back() [1985/4950]

x species_pp_AUID push_back ( "09de54d57c47f394"  )

◆ push_back() [1986/4950]

x species_pp_groundstate_structure push_back ( "N/A_09de54d57c47f394"  )

◆ push_back() [1987/4950]

x vEATOM push_back ( 380.  8578)

◆ push_back() [1988/4950]

x vTITEL push_back ( "PAW_GGARb_sv10Feb1998"  )

◆ push_back() [1989/4950]

x species_pp_version push_back ( "Rb_sv:PAW_GGA:10Feb1998"  )

◆ push_back() [1990/4950]

x species_pp_AUID push_back ( "28c841a3ca6ae2f0"  )

◆ push_back() [1991/4950]

x species_pp_groundstate_structure push_back ( "N/A_28c841a3ca6ae2f0"  )

◆ push_back() [1992/4950]

x vEATOM push_back ( 663.  129)

◆ push_back() [1993/4950]

x vTITEL push_back ( "PAW_GGARe05Jan2001"  )

◆ push_back() [1994/4950]

x species_pp_version push_back ( "Re:PAW_GGA:05Jan2001"  )

◆ push_back() [1995/4950]

x species_pp_AUID push_back ( "1e59564cdfe6dd0a"  )

◆ push_back() [1996/4950]

x vTITEL push_back ( "PAW_GGARe_pv11Feb1998"  )

◆ push_back() [1997/4950]

x species_pp_version push_back ( "Re_pv:PAW_GGA:11Feb1998"  )

◆ push_back() [1998/4950]

x species_pp_AUID push_back ( "754454a117ea525b"  )

◆ push_back() [1999/4950]

x vEATOM push_back ( 1505.  4609)

◆ push_back() [2000/4950]

x vTITEL push_back ( "PAW_GGARh04May1998"  )

◆ push_back() [2001/4950]

x species_pp_version push_back ( "Rh:PAW_GGA:04May1998"  )

◆ push_back() [2002/4950]

x species_pp_AUID push_back ( "2297d0177b7db39d"  )

◆ push_back() [2003/4950]

x vEATOM push_back ( 617.  2984)

◆ push_back() [2004/4950]

x vTITEL push_back ( "PAW_GGARh_pv17Apr2000"  )

◆ push_back() [2005/4950]

x species_pp_version push_back ( "Rh_pv:PAW_GGA:17Apr2000"  )

◆ push_back() [2006/4950]

x species_pp_AUID push_back ( "e9aa6eb55d4587f1"  )

◆ push_back() [2007/4950]

x vEATOM push_back ( 2227.  7667)

◆ push_back() [2008/4950]

x vTITEL push_back ( "PAW_GGARu03Mar1998"  )

◆ push_back() [2009/4950]

x species_pp_version push_back ( "Ru:PAW_GGA:03Mar1998"  )

◆ push_back() [2010/4950]

x species_pp_AUID push_back ( "48750268bde7c56d"  )

◆ push_back() [2011/4950]

x vEATOM push_back ( 455.  6262)

◆ push_back() [2012/4950]

x vTITEL push_back ( "PAW_GGARu_pv10Feb1998"  )

◆ push_back() [2013/4950]

x species_pp_version push_back ( "Ru_pv:PAW_GGA:10Feb1998"  )

◆ push_back() [2014/4950]

x species_pp_AUID push_back ( "24117781e96ec111"  )

◆ push_back() [2015/4950]

x vEATOM push_back ( 1874.  683)

◆ push_back() [2016/4950]

x vTITEL push_back ( "PAW_GGARu_sv02Oct2001"  )

◆ push_back() [2017/4950]

x species_pp push_back ( "Ru_sv"  )

◆ push_back() [2018/4950]

x species_pp_version push_back ( "Ru_sv:PAW_GGA:02Oct2001"  )

◆ push_back() [2019/4950]

x species_pp_AUID push_back ( "c6fbedbf10339a1d"  )

◆ push_back() [2020/4950]

x vEATOM push_back ( 2595.  1749)

◆ push_back() [2021/4950]

x vTITEL push_back ( "PAW_GGASb04May1998"  )

◆ push_back() [2022/4950]

x species_pp_version push_back ( "Sb:PAW_GGA:04May1998"  )

◆ push_back() [2023/4950]

x species_pp_AUID push_back ( "af48b8bad77676b8"  )

◆ push_back() [2024/4950]

x species_pp_groundstate_structure push_back ( "N/A_af48b8bad77676b8"  )

◆ push_back() [2025/4950]

x vTITEL push_back ( "PAW_GGASc08Aug2001"  )

◆ push_back() [2026/4950]

x species_pp_version push_back ( "Sc:PAW_GGA:08Aug2001"  )

◆ push_back() [2027/4950]

x species_pp_AUID push_back ( "1d27da013e36ce9b"  )

◆ push_back() [2028/4950]

x vEATOM push_back ( 44.  8673)

◆ push_back() [2029/4950]

x vTITEL push_back ( "PAW_GGASc_sv07Sep2000"  )

◆ push_back() [2030/4950]

x species_pp_version push_back ( "Sc_sv:PAW_GGA:07Sep2000"  )

◆ push_back() [2031/4950]

x species_pp_AUID push_back ( "a563cb0b31f21d93"  )

◆ push_back() [2032/4950]

x vEATOM push_back ( 1274.  1977)

◆ push_back() [2033/4950]

x vTITEL push_back ( "PAW_GGASe04May1998"  )

◆ push_back() [2034/4950]

x species_pp_version push_back ( "Se:PAW_GGA:04May1998"  )

◆ push_back() [2035/4950]

x species_pp_AUID push_back ( "1443ead072bb87fa"  )

◆ push_back() [2036/4950]

x species_pp_groundstate_structure push_back ( "N/A_1443ead072bb87fa"  )

◆ push_back() [2037/4950]

x vEATOM push_back ( 257.  5864)

◆ push_back() [2038/4950]

x vTITEL push_back ( "PAW_GGAS_h08Apr2002"  )

◆ push_back() [2039/4950]

x species_pp_version push_back ( "S_h:PAW_GGA:08Apr2002"  )

◆ push_back() [2040/4950]

x species_pp_AUID push_back ( "079993a9fa4563c7"  )

◆ push_back() [2041/4950]

x species_pp_groundstate_structure push_back ( "N/A_079993a9fa4563c7"  )

◆ push_back() [2042/4950]

x vTITEL push_back ( "PAW_GGASi_h08Apr2002"  )

◆ push_back() [2043/4950]

x species_pp_version push_back ( "Si_h:PAW_GGA:08Apr2002"  )

◆ push_back() [2044/4950]

x species_pp_AUID push_back ( "096bd93da38a71ba"  )

◆ push_back() [2045/4950]

x vTITEL push_back ( "PAW_GGASi05Jan2001"  )

◆ push_back() [2046/4950]

x species_pp_version push_back ( "Si:PAW_GGA:05Jan2001"  )

◆ push_back() [2047/4950]

x species_pp_AUID push_back ( "d47b3f10236456be"  )

◆ push_back() [2048/4950]

x vTITEL push_back ( "PAW_GGASm_207Jan2002"  )

◆ push_back() [2049/4950]

x species_pp push_back ( "Sm"  )

◆ push_back() [2050/4950]

x species_Z push_back ( 62  )

◆ push_back() [2051/4950]

x species_pp push_back ( "Sm_2"  )

◆ push_back() [2052/4950]

x species_pp_version push_back ( "Sm_2:PAW_GGA:07Jan2002"  )

◆ push_back() [2053/4950]

x species_pp_AUID push_back ( "abf5fafa86239cc5"  )

◆ push_back() [2054/4950]

x species_pp_groundstate_structure push_back ( "N/A_abf5fafa86239cc5"  )

◆ push_back() [2055/4950]

x vEATOM push_back ( 828.  8171)

◆ push_back() [2056/4950]

x vTITEL push_back ( "PAW_GGASm_311May2000"  )

◆ push_back() [2057/4950]

x species_pp push_back ( "Sm_3"  )

◆ push_back() [2058/4950]

x species_pp_version push_back ( "Sm_3:PAW_GGA:11May2000"  )

◆ push_back() [2059/4950]

x species_pp_AUID push_back ( "8d38efd1df55cc4b"  )

◆ push_back() [2060/4950]

x species_pp_groundstate_structure push_back ( "C19"  )

◆ push_back() [2061/4950]

x vEATOM push_back ( 974.  3881)

◆ push_back() [2062/4950]

x vTITEL push_back ( "PAW_GGASn_d04May1998"  )

◆ push_back() [2063/4950]

x species_pp_version push_back ( "Sn_d:PAW_GGA:04May1998"  )

◆ push_back() [2064/4950]

x species_pp_AUID push_back ( "08613a653976bf20"  )

◆ push_back() [2065/4950]

x species_pp_groundstate_structure push_back ( "N/A_08613a653976bf20"  )

◆ push_back() [2066/4950]

x vEATOM push_back ( 1894.  656)

◆ push_back() [2067/4950]

x vTITEL push_back ( "PAW_GGASn07Sep2001"  )

◆ push_back() [2068/4950]

x species_pp_version push_back ( "Sn:PAW_GGA:07Sep2001"  )

◆ push_back() [2069/4950]

x species_pp_AUID push_back ( "bc3de5f1b8cdd3ff"  )

◆ push_back() [2070/4950]

x species_pp_groundstate_structure push_back ( "N/A_bc3de5f1b8cdd3ff"  )

◆ push_back() [2071/4950]

x vEATOM push_back ( 94.  3376)

◆ push_back() [2072/4950]

x vTITEL push_back ( "PAW_GGAS21Jan2003"  )

◆ push_back() [2073/4950]

x species_pp_version push_back ( "S:PAW_GGA:21Jan2003"  )

◆ push_back() [2074/4950]

x species_pp_AUID push_back ( "5b8a4c4c465f5c98"  )

◆ push_back() [2075/4950]

x species_pp_groundstate_structure push_back ( "N/A_5b8a4c4c465f5c98"  )

◆ push_back() [2076/4950]

x vTITEL push_back ( "PAW_GGASr_sv10Feb1998"  )

◆ push_back() [2077/4950]

x species_pp_version push_back ( "Sr_sv:PAW_GGA:10Feb1998"  )

◆ push_back() [2078/4950]

x species_pp_AUID push_back ( "bbfa6aec08364643"  )

◆ push_back() [2079/4950]

x vEATOM push_back ( 843.  674)

◆ push_back() [2080/4950]

x vTITEL push_back ( "PAW_GGATa06Feb2003"  )

◆ push_back() [2081/4950]

x species_pp_version push_back ( "Ta:PAW_GGA:06Feb2003"  )

◆ push_back() [2082/4950]

x species_pp_AUID push_back ( "c88d4f9a05e45d41"  )

◆ push_back() [2083/4950]

x vEATOM push_back ( 131.  0691)

◆ push_back() [2084/4950]

x vTITEL push_back ( "PAW_GGATa_pv07Sep2000"  )

◆ push_back() [2085/4950]

x species_pp_version push_back ( "Ta_pv:PAW_GGA:07Sep2000"  )

◆ push_back() [2086/4950]

x species_pp_AUID push_back ( "de2a3eb2f27e9633"  )

◆ push_back() [2087/4950]

x vEATOM push_back ( 1047.  1517)

◆ push_back() [2088/4950]

x vTITEL push_back ( "PAW_GGATb_310May2000"  )

◆ push_back() [2089/4950]

x species_pp push_back ( "Tb"  )

◆ push_back() [2090/4950]

x species_Z push_back ( 65  )

◆ push_back() [2091/4950]

x species_pp push_back ( "Tb_3"  )

◆ push_back() [2092/4950]

x species_pp_version push_back ( "Tb_3:PAW_GGA:10May2000"  )

◆ push_back() [2093/4950]

x species_pp_AUID push_back ( "d073e71f6464506a"  )

◆ push_back() [2094/4950]

x species_pp_groundstate_structure push_back ( "N/A_d073e71f6464506a"  )

◆ push_back() [2095/4950]

x vTITEL push_back ( "PAW_GGATc21Dec2000"  )

◆ push_back() [2096/4950]

x species_pp_version push_back ( "Tc:PAW_GGA:21Dec2000"  )

◆ push_back() [2097/4950]

x species_pp_AUID push_back ( "80004c8d11aa64f2"  )

◆ push_back() [2098/4950]

x vEATOM push_back ( 323.  3416)

◆ push_back() [2099/4950]

x vTITEL push_back ( "PAW_GGATc_pv20Feb1998"  )

◆ push_back() [2100/4950]

x species_pp_version push_back ( "Tc_pv:PAW_GGA:20Feb1998"  )

◆ push_back() [2101/4950]

x species_pp_AUID push_back ( "0eb01e3427b59ddc"  )

◆ push_back() [2102/4950]

x vEATOM push_back ( 1561.  3264)

◆ push_back() [2103/4950]

x vTITEL push_back ( "PAW_GGATe07Sep2001"  )

◆ push_back() [2104/4950]

x species_pp_version push_back ( "Te:PAW_GGA:07Sep2001"  )

◆ push_back() [2105/4950]

x species_pp_AUID push_back ( "f3d606366f98e5ea"  )

◆ push_back() [2106/4950]

x species_pp_groundstate_structure push_back ( "N/A_f3d606366f98e5ea"  )

◆ push_back() [2107/4950]

x vEATOM push_back ( 223.  663)

◆ push_back() [2108/4950]

x vTITEL push_back ( "PAW_GGATh11Apr2000"  )

◆ push_back() [2109/4950]

x species_pp_version push_back ( "Th:PAW_GGA:11Apr2000"  )

◆ push_back() [2110/4950]

x species_pp_AUID push_back ( "8892caefc75e0a45"  )

◆ push_back() [2111/4950]

x species_pp_groundstate_structure push_back ( "N/A_8892caefc75e0a45"  )

◆ push_back() [2112/4950]

x vTITEL push_back ( "PAW_GGATh_s04May2000"  )

◆ push_back() [2113/4950]

x species_pp_version push_back ( "Th_s:PAW_GGA:04May2000"  )

◆ push_back() [2114/4950]

x species_pp_AUID push_back ( "f1626be755629dfe"  )

◆ push_back() [2115/4950]

x species_pp_groundstate_structure push_back ( "N/A_f1626be755629dfe"  )

◆ push_back() [2116/4950]

x vEATOM push_back ( 631.  1023)

◆ push_back() [2117/4950]

x vTITEL push_back ( "PAW_GGATi08Aug2001"  )

◆ push_back() [2118/4950]

x species_pp_version push_back ( "Ti:PAW_GGA:08Aug2001"  )

◆ push_back() [2119/4950]

x species_pp_AUID push_back ( "47d8726ba10b866f"  )

◆ push_back() [2120/4950]

x vTITEL push_back ( "PAW_GGATi_pv07Sep2000"  )

◆ push_back() [2121/4950]

x species_pp_version push_back ( "Ti_pv:PAW_GGA:07Sep2000"  )

◆ push_back() [2122/4950]

x species_pp_AUID push_back ( "8fecbeeb2db133cb"  )

◆ push_back() [2123/4950]

x vEATOM push_back ( 1043.  6922)

◆ push_back() [2124/4950]

x vTITEL push_back ( "PAW_GGATi_sv07Sep2000"  )

◆ push_back() [2125/4950]

x species_pp_version push_back ( "Ti_sv:PAW_GGA:07Sep2000"  )

◆ push_back() [2126/4950]

x species_pp_AUID push_back ( "c8c8567f19acfb26"  )

◆ push_back() [2127/4950]

x vEATOM push_back ( 1589.  12)

◆ push_back() [2128/4950]

x vTITEL push_back ( "PAW_GGATl_d11Feb1998"  )

◆ push_back() [2129/4950]

x species_pp_version push_back ( "Tl_d:PAW_GGA:11Feb1998"  )

◆ push_back() [2130/4950]

x species_pp_AUID push_back ( "958e09d75d34dcd0"  )

◆ push_back() [2131/4950]

x vEATOM push_back ( 1392.  8479)

◆ push_back() [2132/4950]

x vTITEL push_back ( "PAW_GGATl25Jul2001"  )

◆ push_back() [2133/4950]

x species_pp_version push_back ( "Tl:PAW_GGA:25Jul2001"  )

◆ push_back() [2134/4950]

x species_pp_AUID push_back ( "1298edb6f5cd44f1"  )

◆ push_back() [2135/4950]

x vEATOM push_back ( 57.  647)

◆ push_back() [2136/4950]

x vTITEL push_back ( "PAW_GGATm_310May2000"  )

◆ push_back() [2137/4950]

x species_pp push_back ( "Tm"  )

◆ push_back() [2138/4950]

x species_Z push_back ( 69  )

◆ push_back() [2139/4950]

x species_pp push_back ( "Tm_3"  )

◆ push_back() [2140/4950]

x species_pp_version push_back ( "Tm_3:PAW_GGA:10May2000"  )

◆ push_back() [2141/4950]

x species_pp_AUID push_back ( "1726267d839c6fde"  )

◆ push_back() [2142/4950]

x species_pp_groundstate_structure push_back ( "N/A_1726267d839c6fde"  )

◆ push_back() [2143/4950]

x vEATOM push_back ( 683.  1466)

◆ push_back() [2144/4950]

x vTITEL push_back ( "PAW_GGATm21Aug2000"  )

◆ push_back() [2145/4950]

x species_pp_version push_back ( "Tm:PAW_GGA:21Aug2000"  )

◆ push_back() [2146/4950]

x species_pp_AUID push_back ( "42865e4a884555f3"  )

◆ push_back() [2147/4950]

x species_pp_groundstate_structure push_back ( "N/A_42865e4a884555f3"  )

◆ push_back() [2148/4950]

x vEATOM push_back ( 5989.  9073)

◆ push_back() [2149/4950]

x vTITEL push_back ( "PAW_GGAU14Apr2000"  )

◆ push_back() [2150/4950]

x species_pp_version push_back ( "U:PAW_GGA:14Apr2000"  )

◆ push_back() [2151/4950]

x species_pp_AUID push_back ( "557c79725968cd4c"  )

◆ push_back() [2152/4950]

x species_pp_groundstate_structure push_back ( "N/A_557c79725968cd4c"  )

◆ push_back() [2153/4950]

x vEATOM push_back ( 1405.  4593)

◆ push_back() [2154/4950]

x vTITEL push_back ( "PAW_GGAU_s04May2000"  )

◆ push_back() [2155/4950]

x species_pp_version push_back ( "U_s:PAW_GGA:04May2000"  )

◆ push_back() [2156/4950]

x species_pp_AUID push_back ( "8ca5c7be77fbe869"  )

◆ push_back() [2157/4950]

x species_pp_groundstate_structure push_back ( "N/A_8ca5c7be77fbe869"  )

◆ push_back() [2158/4950]

x vTITEL push_back ( "PAW_GGAV07Aug2001"  )

◆ push_back() [2159/4950]

x species_pp_version push_back ( "V:PAW_GGA:07Aug2001"  )

◆ push_back() [2160/4950]

x species_pp_AUID push_back ( "dce68ed9d844d970"  )

◆ push_back() [2161/4950]

x vTITEL push_back ( "PAW_GGAV_pv07Sep2000"  )

◆ push_back() [2162/4950]

x species_pp_version push_back ( "V_pv:PAW_GGA:07Sep2000"  )

◆ push_back() [2163/4950]

x species_pp_AUID push_back ( "1dd37802a9ba101a"  )

◆ push_back() [2164/4950]

x vTITEL push_back ( "PAW_GGAV_sv14Sep2000"  )

◆ push_back() [2165/4950]

x species_pp_version push_back ( "V_sv:PAW_GGA:14Sep2000"  )

◆ push_back() [2166/4950]

x species_pp_AUID push_back ( "6555390e553533e4"  )

◆ push_back() [2167/4950]

x vTITEL push_back ( "PAW_GGAW21Dec2000"  )

◆ push_back() [2168/4950]

x species_pp_version push_back ( "W:PAW_GGA:21Dec2000"  )

◆ push_back() [2169/4950]

x species_pp_AUID push_back ( "4a36ee2cfb9fae34"  )

◆ push_back() [2170/4950]

x vEATOM push_back ( 205.  1475)

◆ push_back() [2171/4950]

x vTITEL push_back ( "PAW_GGAW_pv15Jul1998"  )

◆ push_back() [2172/4950]

x species_pp_version push_back ( "W_pv:PAW_GGA:15Jul1998"  )

◆ push_back() [2173/4950]

x species_pp_AUID push_back ( "22a83c4c0d26e6eb"  )

◆ push_back() [2174/4950]

x vEATOM push_back ( 1261.  6387)

◆ push_back() [2175/4950]

x vTITEL push_back ( "PAW_GGAXe07Sep2000"  )

◆ push_back() [2176/4950]

x species_pp_version push_back ( "Xe:PAW_GGA:07Sep2000"  )

◆ push_back() [2177/4950]

x species_pp_AUID push_back ( "74dee9954c4f02ec"  )

◆ push_back() [2178/4950]

x species_pp_groundstate_structure push_back ( "N/A_74dee9954c4f02ec"  )

◆ push_back() [2179/4950]

x vTITEL push_back ( "PAW_GGAYb_210May2000"  )

◆ push_back() [2180/4950]

x species_pp push_back ( "Yb"  )

◆ push_back() [2181/4950]

x species_Z push_back ( 70  )

◆ push_back() [2182/4950]

x species_pp push_back ( "Yb_2"  )

◆ push_back() [2183/4950]

x species_pp_version push_back ( "Yb_2:PAW_GGA:10May2000"  )

◆ push_back() [2184/4950]

x species_pp_AUID push_back ( "b1f8bc4d83e97833"  )

◆ push_back() [2185/4950]

x vEATOM push_back ( 571.  8816)

◆ push_back() [2186/4950]

x vTITEL push_back ( "PAW_GGAYb05Sep2000"  )

◆ push_back() [2187/4950]

x species_pp_version push_back ( "Yb:PAW_GGA:05Sep2000"  )

◆ push_back() [2188/4950]

x species_pp_AUID push_back ( "72365976ebb8deda"  )

◆ push_back() [2189/4950]

x species_pp_groundstate_structure push_back ( "N/A_72365976ebb8deda"  )

◆ push_back() [2190/4950]

x vEATOM push_back ( 6751.  5454)

◆ push_back() [2191/4950]

x vRMAX push_back ( )

◆ push_back() [2192/4950]

x vLEXCH push_back ( "PE"  )

◆ push_back() [2193/4950]

x vTITEL push_back ( "PAW_GGAY_sv10Feb1998"  )

◆ push_back() [2194/4950]

x species_pp_version push_back ( "Y_sv:PAW_GGA:10Feb1998"  )

◆ push_back() [2195/4950]

x species_pp_AUID push_back ( "20813d90f7aff62f"  )

◆ push_back() [2196/4950]

x vTITEL push_back ( "PAW_GGAZn03Mar1998"  )

◆ push_back() [2197/4950]

x species_pp_version push_back ( "Zn:PAW_GGA:03Mar1998"  )

◆ push_back() [2198/4950]

x species_pp_AUID push_back ( "e75d47ef817f48d8"  )

◆ push_back() [2199/4950]

x vEATOM push_back ( 1751.  1685)

◆ push_back() [2200/4950]

x vTITEL push_back ( "PAW_GGAZr08Aug2001"  )

◆ push_back() [2201/4950]

x species_pp_version push_back ( "Zr:PAW_GGA:08Aug2001"  )

◆ push_back() [2202/4950]

x species_pp_AUID push_back ( "05c7a473e8b0fed1"  )

◆ push_back() [2203/4950]

x vTITEL push_back ( "PAW_GGAZr_sv10Feb1998"  )

◆ push_back() [2204/4950]

x species_pp_version push_back ( "Zr_sv:PAW_GGA:10Feb1998"  )

◆ push_back() [2205/4950]

x species_pp_AUID push_back ( "7471a45b48d5cbca"  )

◆ push_back() [2206/4950]

x vEATOM push_back ( 1284.  983)

◆ push_back() [2207/4950]

x vTITEL push_back ( "PAW_PBEAc06Sep2000"  )

◆ push_back() [2208/4950]

x species_pp_version push_back ( "Ac:PAW_PBE:06Sep2000"  )

◆ push_back() [2209/4950]

x species_pp_AUID push_back ( "335f20e70f06b78b"  )

◆ push_back() [2210/4950]

x vEATOM push_back ( 812.  3392)

◆ push_back() [2211/4950]

x vTITEL push_back ( "PAW_PBEAc_s06Sep2000"  )

◆ push_back() [2212/4950]

x species_pp_version push_back ( "Ac_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2213/4950]

x species_pp_AUID push_back ( "06e8eff4a6b826a0"  )

◆ push_back() [2214/4950]

x vEATOM push_back ( 500.  9084)

◆ push_back() [2215/4950]

x vTITEL push_back ( "PAW_PBEAg06Sep2000"  )

◆ push_back() [2216/4950]

x species_pp_version push_back ( "Ag:PAW_PBE:06Sep2000"  )

◆ push_back() [2217/4950]

x species_pp_AUID push_back ( "eca65d7d992efb48"  )

◆ push_back() [2218/4950]

x vEATOM push_back ( 1037.  4134)

◆ push_back() [2219/4950]

x vTITEL push_back ( "PAW_PBEAl_h08Apr2002"  )

◆ push_back() [2220/4950]

x species_pp_version push_back ( "Al_h:PAW_PBE:08Apr2002"  )

◆ push_back() [2221/4950]

x species_pp_AUID push_back ( "de9492ed3ab234ca"  )

◆ push_back() [2222/4950]

x vTITEL push_back ( "PAW_PBEAl04Jan2001"  )

◆ push_back() [2223/4950]

x species_pp_version push_back ( "Al:PAW_PBE:04Jan2001"  )

◆ push_back() [2224/4950]

x species_pp_AUID push_back ( "423324aa45d0242f"  )

◆ push_back() [2225/4950]

x vTITEL push_back ( "PAW_PBEAr07Sep2000"  )

◆ push_back() [2226/4950]

x species_pp_version push_back ( "Ar:PAW_PBE:07Sep2000"  )

◆ push_back() [2227/4950]

x species_pp_AUID push_back ( "76ed84ac7c922a74"  )

◆ push_back() [2228/4950]

x vTITEL push_back ( "PAW_PBEAs06Sep2000"  )

◆ push_back() [2229/4950]

x species_pp_version push_back ( "As:PAW_PBE:06Sep2000"  )

◆ push_back() [2230/4950]

x species_pp_AUID push_back ( "f1de4433a638eae7"  )

◆ push_back() [2231/4950]

x species_pp_groundstate_structure push_back ( "A7"  )

◆ push_back() [2232/4950]

x vTITEL push_back ( "PAW_PBEAu06Sep2000"  )

◆ push_back() [2233/4950]

x species_pp_version push_back ( "Au:PAW_PBE:06Sep2000"  )

◆ push_back() [2234/4950]

x species_pp_AUID push_back ( "3477c9645a808524"  )

◆ push_back() [2235/4950]

x vTITEL push_back ( "PAW_PBEBa_sv06Sep2000"  )

◆ push_back() [2236/4950]

x species_pp_version push_back ( "Ba_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2237/4950]

x species_pp_AUID push_back ( "062068333d4e7e80"  )

◆ push_back() [2238/4950]

x vTITEL push_back ( "PAW_PBEBe06Sep2000"  )

◆ push_back() [2239/4950]

x species_pp_version push_back ( "Be:PAW_PBE:06Sep2000"  )

◆ push_back() [2240/4950]

x species_pp_AUID push_back ( "250ccb49102b1ab7"  )

◆ push_back() [2241/4950]

x vTITEL push_back ( "PAW_PBEBe_sv06Sep2000"  )

◆ push_back() [2242/4950]

x species_pp_version push_back ( "Be_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2243/4950]

x species_pp_AUID push_back ( "80136f0733d30e11"  )

◆ push_back() [2244/4950]

x vTITEL push_back ( "PAW_PBEB_h07Sep2000"  )

◆ push_back() [2245/4950]

x species_pp_version push_back ( "B_h:PAW_PBE:07Sep2000"  )

◆ push_back() [2246/4950]

x species_pp_AUID push_back ( "76781ebe8489383f"  )

◆ push_back() [2247/4950]

x vTITEL push_back ( "PAW_PBEBi_d06Sep2000"  )

◆ push_back() [2248/4950]

x species_pp_version push_back ( "Bi_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2249/4950]

x species_pp_AUID push_back ( "bba01b714d812459"  )

◆ push_back() [2250/4950]

x vEATOM push_back ( 1958.  6135)

◆ push_back() [2251/4950]

x vTITEL push_back ( "PAW_PBEBi08Apr2002"  )

◆ push_back() [2252/4950]

x species_pp_version push_back ( "Bi:PAW_PBE:08Apr2002"  )

◆ push_back() [2253/4950]

x species_pp_AUID push_back ( "8b1158914bff5430"  )

◆ push_back() [2254/4950]

x vTITEL push_back ( "PAW_PBEB06Sep2000"  )

◆ push_back() [2255/4950]

x species_pp_version push_back ( "B:PAW_PBE:06Sep2000"  )

◆ push_back() [2256/4950]

x species_pp_AUID push_back ( "970a81e6eadc16b0"  )

◆ push_back() [2257/4950]

x species_pp_groundstate_structure push_back ( "N/A_970a81e6eadc16b0"  )

◆ push_back() [2258/4950]

x vTITEL push_back ( "PAW_PBEBr06Sep2000"  )

◆ push_back() [2259/4950]

x species_pp_version push_back ( "Br:PAW_PBE:06Sep2000"  )

◆ push_back() [2260/4950]

x species_pp_AUID push_back ( "c53210bda32c7827"  )

◆ push_back() [2261/4950]

x vTITEL push_back ( "PAW_PBEB_s22Jan2003"  )

◆ push_back() [2262/4950]

x species_pp_version push_back ( "B_s:PAW_PBE:22Jan2003"  )

◆ push_back() [2263/4950]

x species_pp_AUID push_back ( "a7226ec232e2ee27"  )

◆ push_back() [2264/4950]

x vTITEL push_back ( "PAW_PBECa_pv06Sep2000"  )

◆ push_back() [2265/4950]

x species_pp_version push_back ( "Ca_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2266/4950]

x species_pp_AUID push_back ( "b216760dca178acb"  )

◆ push_back() [2267/4950]

x vEATOM push_back ( 612.  5326)

◆ push_back() [2268/4950]

x vTITEL push_back ( "PAW_PBECa_sv06Sep2000"  )

◆ push_back() [2269/4950]

x species_pp_version push_back ( "Ca_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2270/4950]

x species_pp_AUID push_back ( "a5df1335919961ad"  )

◆ push_back() [2271/4950]

x vEATOM push_back ( 1005.  7249)

◆ push_back() [2272/4950]

x vTITEL push_back ( "PAW_PBECd06Sep2000"  )

◆ push_back() [2273/4950]

x species_pp_version push_back ( "Cd:PAW_PBE:06Sep2000"  )

◆ push_back() [2274/4950]

x species_pp_AUID push_back ( "3388a058d6fd344d"  )

◆ push_back() [2275/4950]

x vEATOM push_back ( 1293.  2795)

◆ push_back() [2276/4950]

x vTITEL push_back ( "PAW_PBECe_306Sep2000"  )

◆ push_back() [2277/4950]

x species_pp_version push_back ( "Ce_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2278/4950]

x species_pp_AUID push_back ( "abfa73bca84b87e0"  )

◆ push_back() [2279/4950]

x vEATOM push_back ( 889.  4219)

◆ push_back() [2280/4950]

x vTITEL push_back ( "PAW_PBECe28Sep2000"  )

◆ push_back() [2281/4950]

x species_pp_version push_back ( "Ce:PAW_PBE:28Sep2000"  )

◆ push_back() [2282/4950]

x species_pp_AUID push_back ( "6e846dc10a52b11b"  )

◆ push_back() [2283/4950]

x vTITEL push_back ( "PAW_PBEC_h20Dec2001"  )

◆ push_back() [2284/4950]

x species_pp_version push_back ( "C_h:PAW_PBE:20Dec2001"  )

◆ push_back() [2285/4950]

x species_pp_AUID push_back ( "f3800ea7e3e20d86"  )

◆ push_back() [2286/4950]

x vTITEL push_back ( "PAW_PBECl_h08Apr2002"  )

◆ push_back() [2287/4950]

x species_pp_version push_back ( "Cl_h:PAW_PBE:08Apr2002"  )

◆ push_back() [2288/4950]

x species_pp_AUID push_back ( "6dca7e86aecb68cc"  )

◆ push_back() [2289/4950]

x species_pp_groundstate_structure push_back ( "diatom"  )

◆ push_back() [2290/4950]

x vEATOM push_back ( 409.  7259)

◆ push_back() [2291/4950]

x vTITEL push_back ( "PAW_PBECl17Jan2003"  )

◆ push_back() [2292/4950]

x species_pp_version push_back ( "Cl:PAW_PBE:17Jan2003"  )

◆ push_back() [2293/4950]

x species_pp_AUID push_back ( "6bf17162620b7ce3"  )

◆ push_back() [2294/4950]

x vTITEL push_back ( "PAW_PBECo06Sep2000"  )

◆ push_back() [2295/4950]

x species_pp_version push_back ( "Co:PAW_PBE:06Sep2000"  )

◆ push_back() [2296/4950]

x species_pp_AUID push_back ( "9c4653e42c9f870b"  )

◆ push_back() [2297/4950]

x vTITEL push_back ( "PAW_PBEC08Apr2002"  )

◆ push_back() [2298/4950]

x species_pp_version push_back ( "C:PAW_PBE:08Apr2002"  )

◆ push_back() [2299/4950]

x species_pp_AUID push_back ( "a720f5418b5ad14f"  )

◆ push_back() [2300/4950]

x vTITEL push_back ( "PAW_PBECr06Sep2000"  )

◆ push_back() [2301/4950]

x species_pp_version push_back ( "Cr:PAW_PBE:06Sep2000"  )

◆ push_back() [2302/4950]

x species_pp_AUID push_back ( "411ed623d1b5054d"  )

◆ push_back() [2303/4950]

x vTITEL push_back ( "PAW_PBECr_pv07Sep2000"  )

◆ push_back() [2304/4950]

x species_pp_version push_back ( "Cr_pv:PAW_PBE:07Sep2000"  )

◆ push_back() [2305/4950]

x species_pp_AUID push_back ( "f020a26862c0a532"  )

◆ push_back() [2306/4950]

x vEATOM push_back ( 1647.  5667)

◆ push_back() [2307/4950]

x vTITEL push_back ( "PAW_PBEC_s06Sep2000"  )

◆ push_back() [2308/4950]

x species_pp_version push_back ( "C_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2309/4950]

x species_pp_AUID push_back ( "8d30df5759a1e14d"  )

◆ push_back() [2310/4950]

x vTITEL push_back ( "PAW_PBECs_sv08Apr2002"  )

◆ push_back() [2311/4950]

x species_pp_version push_back ( "Cs_sv:PAW_PBE:08Apr2002"  )

◆ push_back() [2312/4950]

x species_pp_AUID push_back ( "e054d996abee22c5"  )

◆ push_back() [2313/4950]

x vEATOM push_back ( 555.  6835)

◆ push_back() [2314/4950]

x vTITEL push_back ( "PAW_PBECu05Jan2001"  )

◆ push_back() [2315/4950]

x species_pp_version push_back ( "Cu:PAW_PBE:05Jan2001"  )

◆ push_back() [2316/4950]

x species_pp_AUID push_back ( "c7a1b91d209a648b"  )

◆ push_back() [2317/4950]

x vEATOM push_back ( 1390.  98)

◆ push_back() [2318/4950]

x vTITEL push_back ( "PAW_PBECu_pv06Sep2000"  )

◆ push_back() [2319/4950]

x species_pp_version push_back ( "Cu_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2320/4950]

x species_pp_AUID push_back ( "62263cf2c885649c"  )

◆ push_back() [2321/4950]

x vEATOM push_back ( 4119.  1903)

◆ push_back() [2322/4950]

x vTITEL push_back ( "PAW_PBEDy_306Sep2000"  )

◆ push_back() [2323/4950]

x species_pp_version push_back ( "Dy_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2324/4950]

x species_pp_AUID push_back ( "0373199190a8abb7"  )

◆ push_back() [2325/4950]

x vTITEL push_back ( "PAW_PBEEr_217Jan2003"  )

◆ push_back() [2326/4950]

x species_pp push_back ( "Er_2"  )

◆ push_back() [2327/4950]

x species_pp_version push_back ( "Er_2:PAW_PBE:17Jan2003"  )

◆ push_back() [2328/4950]

x species_pp_AUID push_back ( "dfc647e5fa0c2243"  )

◆ push_back() [2329/4950]

x species_pp_groundstate_structure push_back ( "N/A_dfc647e5fa0c2243"  )

◆ push_back() [2330/4950]

x vEATOM push_back ( 553.  8763)

◆ push_back() [2331/4950]

x vTITEL push_back ( "PAW_PBEEr_306Sep2000"  )

◆ push_back() [2332/4950]

x species_pp_version push_back ( "Er_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2333/4950]

x species_pp_AUID push_back ( "d843969058538e36"  )

◆ push_back() [2334/4950]

x species_pp_groundstate_structure push_back ( "N/A_d843969058538e36"  )

◆ push_back() [2335/4950]

x vEATOM push_back ( 671.  8481)

◆ push_back() [2336/4950]

x vTITEL push_back ( "PAW_PBEEu_206Sep2000"  )

◆ push_back() [2337/4950]

x species_pp_version push_back ( "Eu_2:PAW_PBE:06Sep2000"  )

◆ push_back() [2338/4950]

x species_pp_AUID push_back ( "6237c9970888a940"  )

◆ push_back() [2339/4950]

x species_pp_groundstate_structure push_back ( "N/A_6237c9970888a940"  )

◆ push_back() [2340/4950]

x vTITEL push_back ( "PAW_PBEEu08Apr2002"  )

◆ push_back() [2341/4950]

x species_pp_version push_back ( "Eu:PAW_PBE:08Apr2002"  )

◆ push_back() [2342/4950]

x species_pp_AUID push_back ( "9b801fd8fd52e116"  )

◆ push_back() [2343/4950]

x vEATOM push_back ( 2619.  8085)

◆ push_back() [2344/4950]

x vTITEL push_back ( "PAW_PBEFe06Sep2000"  )

◆ push_back() [2345/4950]

x species_pp_version push_back ( "Fe:PAW_PBE:06Sep2000"  )

◆ push_back() [2346/4950]

x species_pp_AUID push_back ( "f5bec9ed423a0ff3"  )

◆ push_back() [2347/4950]

x vEATOM push_back ( 594.  4687)

◆ push_back() [2348/4950]

x vTITEL push_back ( "PAW_PBEFe_pv06Sep2000"  )

◆ push_back() [2349/4950]

x species_pp_version push_back ( "Fe_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2350/4950]

x species_pp_AUID push_back ( "15e65f5e50047695"  )

◆ push_back() [2351/4950]

x vEATOM push_back ( 2456.  8974)

◆ push_back() [2352/4950]

x vTITEL push_back ( "PAW_PBEF_h07Sep2000"  )

◆ push_back() [2353/4950]

x species_pp_version push_back ( "F_h:PAW_PBE:07Sep2000"  )

◆ push_back() [2354/4950]

x species_pp_AUID push_back ( "306f88e141704ce5"  )

◆ push_back() [2355/4950]

x vEATOM push_back ( 659.  4942)

◆ push_back() [2356/4950]

x vTITEL push_back ( "PAW_PBEF08Apr2002"  )

◆ push_back() [2357/4950]

x species_pp_version push_back ( "F:PAW_PBE:08Apr2002"  )

◆ push_back() [2358/4950]

x species_pp_AUID push_back ( "675e493e51b0f2f2"  )

◆ push_back() [2359/4950]

x vTITEL push_back ( "PAW_PBEF_s06Sep2000"  )

◆ push_back() [2360/4950]

x species_pp_version push_back ( "F_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2361/4950]

x species_pp_AUID push_back ( "3defbdd6f1dad3f2"  )

◆ push_back() [2362/4950]

x vTITEL push_back ( "PAW_PBEGa_d06Sep2000"  )

◆ push_back() [2363/4950]

x species_pp_version push_back ( "Ga_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2364/4950]

x species_pp_AUID push_back ( "0cc286ff8e6aa51f"  )

◆ push_back() [2365/4950]

x species_pp_groundstate_structure push_back ( "N/A_0cc286ff8e6aa51f"  )

◆ push_back() [2366/4950]

x vEATOM push_back ( 2149.  0616)

◆ push_back() [2367/4950]

x vTITEL push_back ( "PAW_PBEGa_h09Apr2002"  )

◆ push_back() [2368/4950]

x species_pp_version push_back ( "Ga_h:PAW_PBE:09Apr2002"  )

◆ push_back() [2369/4950]

x species_pp_AUID push_back ( "567d70c3d85e2c7f"  )

◆ push_back() [2370/4950]

x vEATOM push_back ( 2148.  8281)

◆ push_back() [2371/4950]

x vTITEL push_back ( "PAW_PBEGa08Apr2002"  )

◆ push_back() [2372/4950]

x species_pp_version push_back ( "Ga:PAW_PBE:08Apr2002"  )

◆ push_back() [2373/4950]

x species_pp_AUID push_back ( "7648a5ff246046e1"  )

◆ push_back() [2374/4950]

x species_pp_groundstate_structure push_back ( "N/A_7648a5ff246046e1"  )

◆ push_back() [2375/4950]

x vTITEL push_back ( "PAW_PBEGd_306Sep2000"  )

◆ push_back() [2376/4950]

x species_pp_version push_back ( "Gd_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2377/4950]

x species_pp_AUID push_back ( "0ec92114e4e86fc6"  )

◆ push_back() [2378/4950]

x species_pp_groundstate_structure push_back ( "N/A_0ec92114e4e86fc6"  )

◆ push_back() [2379/4950]

x vTITEL push_back ( "PAW_PBEGd08Apr2002"  )

◆ push_back() [2380/4950]

x species_pp_version push_back ( "Gd:PAW_PBE:08Apr2002"  )

◆ push_back() [2381/4950]

x species_pp_AUID push_back ( "c0f01c59eb971d30"  )

◆ push_back() [2382/4950]

x species_pp_groundstate_structure push_back ( "N/A_c0f01c59eb971d30"  )

◆ push_back() [2383/4950]

x vEATOM push_back ( 3047.  6015)

◆ push_back() [2384/4950]

x vTITEL push_back ( "PAW_PBEGe_d06Sep2000"  )

◆ push_back() [2385/4950]

x species_pp_version push_back ( "Ge_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2386/4950]

x species_pp_AUID push_back ( "1a9537cf1728245b"  )

◆ push_back() [2387/4950]

x vEATOM push_back ( 2596.  4246)

◆ push_back() [2388/4950]

x vTITEL push_back ( "PAW_PBEGe_h09Apr2002"  )

◆ push_back() [2389/4950]

x species_pp_version push_back ( "Ge_h:PAW_PBE:09Apr2002"  )

◆ push_back() [2390/4950]

x species_pp_AUID push_back ( "23df10d879b3b58b"  )

◆ push_back() [2391/4950]

x vTITEL push_back ( "PAW_PBEGe05Jan2001"  )

◆ push_back() [2392/4950]

x species_pp_version push_back ( "Ge:PAW_PBE:05Jan2001"  )

◆ push_back() [2393/4950]

x species_pp_AUID push_back ( "e58c5d01a1b37232"  )

◆ push_back() [2394/4950]

x vEATOM push_back ( 104.  996)

◆ push_back() [2395/4950]

x vTITEL push_back ( "PAW_PBEH1.2507Sep2000"  )

◆ push_back() [2396/4950]

x species_pp_version push_back ( "H1.25:PAW_PBE:07Sep2000"  )

◆ push_back() [2397/4950]

x species_pp_AUID push_back ( "11fed2d10dc11a63"  )

◆ push_back() [2398/4950]

x species_pp_groundstate_structure push_back ( "N/A_11fed2d10dc11a63"  )

◆ push_back() [2399/4950]

x vTITEL push_back ( "PAW_PBEH1.507Sep2000"  )

◆ push_back() [2400/4950]

x species_pp_version push_back ( "H1.5:PAW_PBE:07Sep2000"  )

◆ push_back() [2401/4950]

x species_pp_AUID push_back ( "8a694116e1667363"  )

◆ push_back() [2402/4950]

x species_pp_groundstate_structure push_back ( "N/A_8a694116e1667363"  )

◆ push_back() [2403/4950]

x vTITEL push_back ( "PAW_PBEH.507Sep2000"  )

◆ push_back() [2404/4950]

x species_pp_version push_back ( "H.5:PAW_PBE:07Sep2000"  )

◆ push_back() [2405/4950]

x species_pp_AUID push_back ( "3c48a10d07ac5337"  )

◆ push_back() [2406/4950]

x species_pp_groundstate_structure push_back ( "N/A_3c48a10d07ac5337"  )

◆ push_back() [2407/4950]

x vTITEL push_back ( "PAW_PBEH.7507Sep2000"  )

◆ push_back() [2408/4950]

x species_pp_version push_back ( "H.75:PAW_PBE:07Sep2000"  )

◆ push_back() [2409/4950]

x species_pp_AUID push_back ( "708f14eee2bf051b"  )

◆ push_back() [2410/4950]

x species_pp_groundstate_structure push_back ( "N/A_708f14eee2bf051b"  )

◆ push_back() [2411/4950]

x vTITEL push_back ( "PAW_PBEHe05Jan2001"  )

◆ push_back() [2412/4950]

x species_pp_version push_back ( "He:PAW_PBE:05Jan2001"  )

◆ push_back() [2413/4950]

x species_pp_AUID push_back ( "d3ff93e340e01503"  )

◆ push_back() [2414/4950]

x vTITEL push_back ( "PAW_PBEHf20Jan2003"  )

◆ push_back() [2415/4950]

x species_pp_version push_back ( "Hf:PAW_PBE:20Jan2003"  )

◆ push_back() [2416/4950]

x species_pp_AUID push_back ( "2a020b71ae180392"  )

◆ push_back() [2417/4950]

x vEATOM push_back ( 75.  9009)

◆ push_back() [2418/4950]

x vTITEL push_back ( "PAW_PBEHf_pv06Sep2000"  )

◆ push_back() [2419/4950]

x species_pp_version push_back ( "Hf_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2420/4950]

x species_pp_AUID push_back ( "15832a2c336c16e0"  )

◆ push_back() [2421/4950]

x vEATOM push_back ( 859.  6195)

◆ push_back() [2422/4950]

x vTITEL push_back ( "PAW_PBEHg06Sep2000"  )

◆ push_back() [2423/4950]

x species_pp_version push_back ( "Hg:PAW_PBE:06Sep2000"  )

◆ push_back() [2424/4950]

x species_pp_AUID push_back ( "96247dcf8cda9590"  )

◆ push_back() [2425/4950]

x vEATOM push_back ( 1148.  3646)

◆ push_back() [2426/4950]

x vTITEL push_back ( "PAW_PBEH_h07Sep2000"  )

◆ push_back() [2427/4950]

x species_pp_version push_back ( "H_h:PAW_PBE:07Sep2000"  )

◆ push_back() [2428/4950]

x species_pp_AUID push_back ( "48b40c1ec0fc696e"  )

◆ push_back() [2429/4950]

x vTITEL push_back ( "PAW_PBEHo_306Sep2000"  )

◆ push_back() [2430/4950]

x species_pp_version push_back ( "Ho_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2431/4950]

x species_pp_AUID push_back ( "ac7fc7278038dec4"  )

◆ push_back() [2432/4950]

x vEATOM push_back ( 661.  5018)

◆ push_back() [2433/4950]

x vTITEL push_back ( "PAW_PBEH15Jun2001"  )

◆ push_back() [2434/4950]

x species_pp_version push_back ( "H:PAW_PBE:15Jun2001"  )

◆ push_back() [2435/4950]

x species_pp_AUID push_back ( "b4cc088636d527f0"  )

◆ push_back() [2436/4950]

x vTITEL push_back ( "PAW_PBEIn_d06Sep2000"  )

◆ push_back() [2437/4950]

x species_pp_version push_back ( "In_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2438/4950]

x species_pp_AUID push_back ( "5ce1eee07a5df3a7"  )

◆ push_back() [2439/4950]

x species_pp_groundstate_structure push_back ( "A6"  )

◆ push_back() [2440/4950]

x vEATOM push_back ( 1576.  8738)

◆ push_back() [2441/4950]

x vTITEL push_back ( "PAW_PBEIn08Apr2002"  )

◆ push_back() [2442/4950]

x species_pp_version push_back ( "In:PAW_PBE:08Apr2002"  )

◆ push_back() [2443/4950]

x species_pp_AUID push_back ( "963a5b237aaa6725"  )

◆ push_back() [2444/4950]

x species_pp_groundstate_structure push_back ( "N/A_963a5b237aaa6725"  )

◆ push_back() [2445/4950]

x vTITEL push_back ( "PAW_PBEI08Apr2002"  )

◆ push_back() [2446/4950]

x species_pp_version push_back ( "I:PAW_PBE:08Apr2002"  )

◆ push_back() [2447/4950]

x species_pp_AUID push_back ( "7e60ff94db40760b"  )

◆ push_back() [2448/4950]

x species_pp_groundstate_structure push_back ( "A14"  )

◆ push_back() [2449/4950]

x vEATOM push_back ( 315.  8678)

◆ push_back() [2450/4950]

x vTITEL push_back ( "PAW_PBEIr06Sep2000"  )

◆ push_back() [2451/4950]

x species_pp_version push_back ( "Ir:PAW_PBE:06Sep2000"  )

◆ push_back() [2452/4950]

x species_pp_AUID push_back ( "9c41e654d31db16a"  )

◆ push_back() [2453/4950]

x vEATOM push_back ( 560.  2052)

◆ push_back() [2454/4950]

x vTITEL push_back ( "PAW_PBEK_pv17Jan2003"  )

◆ push_back() [2455/4950]

x species_pp_version push_back ( "K_pv:PAW_PBE:17Jan2003"  )

◆ push_back() [2456/4950]

x species_pp_AUID push_back ( "941fbf66b21efd05"  )

◆ push_back() [2457/4950]

x vEATOM push_back ( 450.  4813)

◆ push_back() [2458/4950]

x vTITEL push_back ( "PAW_PBEKr07Sep2000"  )

◆ push_back() [2459/4950]

x species_pp_version push_back ( "Kr:PAW_PBE:07Sep2000"  )

◆ push_back() [2460/4950]

x species_pp_AUID push_back ( "d11aa94f6960dd8f"  )

◆ push_back() [2461/4950]

x species_pp_groundstate_structure push_back ( "N/A_d11aa94f6960dd8f"  )

◆ push_back() [2462/4950]

x vTITEL push_back ( "PAW_PBEK_sv06Sep2000"  )

◆ push_back() [2463/4950]

x species_pp_version push_back ( "K_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2464/4950]

x species_pp_AUID push_back ( "cc26596520b9b525"  )

◆ push_back() [2465/4950]

x vEATOM push_back ( 774.  7423)

◆ push_back() [2466/4950]

x vTITEL push_back ( "PAW_PBELa06Sep2000"  )

◆ push_back() [2467/4950]

x species_pp_version push_back ( "La:PAW_PBE:06Sep2000"  )

◆ push_back() [2468/4950]

x species_pp_AUID push_back ( "8353806ee117d7fd"  )

◆ push_back() [2469/4950]

x vEATOM push_back ( 865.  2204)

◆ push_back() [2470/4950]

x vTITEL push_back ( "PAW_PBELa_s06Sep2000"  )

◆ push_back() [2471/4950]

x species_pp_version push_back ( "La_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2472/4950]

x species_pp_AUID push_back ( "d04dad60260af779"  )

◆ push_back() [2473/4950]

x vEATOM push_back ( 544.  3038)

◆ push_back() [2474/4950]

x vTITEL push_back ( "PAW_PBELi17Jan2003"  )

◆ push_back() [2475/4950]

x species_pp_version push_back ( "Li:PAW_PBE:17Jan2003"  )

◆ push_back() [2476/4950]

x species_pp_AUID push_back ( "d51fe7240453d7c4"  )

◆ push_back() [2477/4950]

x vTITEL push_back ( "PAW_PBELi_sv23Jan2001"  )

◆ push_back() [2478/4950]

x species_pp_version push_back ( "Li_sv:PAW_PBE:23Jan2001"  )

◆ push_back() [2479/4950]

x species_pp_AUID push_back ( "99a2f30dac0e41d6"  )

◆ push_back() [2480/4950]

x vTITEL push_back ( "PAW_PBELu_306Sep2000"  )

◆ push_back() [2481/4950]

x species_pp_version push_back ( "Lu_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2482/4950]

x species_pp_AUID push_back ( "35b974e5b61dbf9a"  )

◆ push_back() [2483/4950]

x species_pp_groundstate_structure push_back ( "N/A_35b974e5b61dbf9a"  )

◆ push_back() [2484/4950]

x vTITEL push_back ( "PAW_PBELu06Sep2000"  )

◆ push_back() [2485/4950]

x species_pp_version push_back ( "Lu:PAW_PBE:06Sep2000"  )

◆ push_back() [2486/4950]

x species_pp_AUID push_back ( "98b3a5d589b252b5"  )

◆ push_back() [2487/4950]

x species_pp_groundstate_structure push_back ( "N/A_98b3a5d589b252b5"  )

◆ push_back() [2488/4950]

x vEATOM push_back ( 7549.  903)

◆ push_back() [2489/4950]

x vTITEL push_back ( "PAW_PBEMg05Jan2001"  )

◆ push_back() [2490/4950]

x species_pp_version push_back ( "Mg:PAW_PBE:05Jan2001"  )

◆ push_back() [2491/4950]

x species_pp_AUID push_back ( "7d88d84366cb7141"  )

◆ push_back() [2492/4950]

x vTITEL push_back ( "PAW_PBEMg_pv06Sep2000"  )

◆ push_back() [2493/4950]

x species_pp_version push_back ( "Mg_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2494/4950]

x species_pp_AUID push_back ( "393ee52ce57367b8"  )

◆ push_back() [2495/4950]

x vEATOM push_back ( 1056.  57)

◆ push_back() [2496/4950]

x vTITEL push_back ( "PAW_PBEMn06Sep2000"  )

◆ push_back() [2497/4950]

x species_pp_version push_back ( "Mn:PAW_PBE:06Sep2000"  )

◆ push_back() [2498/4950]

x species_pp_AUID push_back ( "8f2e213b3592f62e"  )

◆ push_back() [2499/4950]

x species_pp_groundstate_structure push_back ( "A12"  )

◆ push_back() [2500/4950]

x vEATOM push_back ( 416.  8732)

◆ push_back() [2501/4950]

x vTITEL push_back ( "PAW_PBEMn_pv07Sep2000"  )

◆ push_back() [2502/4950]

x species_pp_version push_back ( "Mn_pv:PAW_PBE:07Sep2000"  )

◆ push_back() [2503/4950]

x species_pp_AUID push_back ( "99be850476e2dfb3"  )

◆ push_back() [2504/4950]

x vEATOM push_back ( 2024.  8347)

◆ push_back() [2505/4950]

x species_pp_AUID push_back ( "c90275c91471b466"  )

◆ push_back() [2506/4950]

x vEATOM push_back ( 217.  518)

◆ push_back() [2507/4950]

x vTITEL push_back ( "PAW_PBEMo_pv08Apr2002"  )

◆ push_back() [2508/4950]

x species_pp_version push_back ( "Mo_pv:PAW_PBE:08Apr2002"  )

◆ push_back() [2509/4950]

x species_pp_AUID push_back ( "444a5f723c4c0576"  )

◆ push_back() [2510/4950]

x vTITEL push_back ( "PAW_PBENa08Apr2002"  )

◆ push_back() [2511/4950]

x species_pp_version push_back ( "Na:PAW_PBE:08Apr2002"  )

◆ push_back() [2512/4950]

x species_pp_AUID push_back ( "79f12c5d16cf98b8"  )

◆ push_back() [2513/4950]

x vTITEL push_back ( "PAW_PBENa_pv05Jan2001"  )

◆ push_back() [2514/4950]

x species_pp_version push_back ( "Na_pv:PAW_PBE:05Jan2001"  )

◆ push_back() [2515/4950]

x species_pp_AUID push_back ( "bd75e1ab544c0ed0"  )

◆ push_back() [2516/4950]

x vTITEL push_back ( "PAW_PBENa_sv28Sep2000"  )

◆ push_back() [2517/4950]

x species_pp_version push_back ( "Na_sv:PAW_PBE:28Sep2000"  )

◆ push_back() [2518/4950]

x species_pp_AUID push_back ( "637322e42c89bd5e"  )

◆ push_back() [2519/4950]

x vEATOM push_back ( 1307.  8686)

◆ push_back() [2520/4950]

x vTITEL push_back ( "PAW_PBENb_pv08Apr2002"  )

◆ push_back() [2521/4950]

x species_pp_version push_back ( "Nb_pv:PAW_PBE:08Apr2002"  )

◆ push_back() [2522/4950]

x species_pp_AUID push_back ( "d9711dcad08e9fe9"  )

◆ push_back() [2523/4950]

x vTITEL push_back ( "PAW_PBENb_sv17Jan2003"  )

◆ push_back() [2524/4950]

x species_pp_version push_back ( "Nb_sv:PAW_PBE:17Jan2003"  )

◆ push_back() [2525/4950]

x species_pp_AUID push_back ( "141a7bea5919e0b3"  )

◆ push_back() [2526/4950]

x vTITEL push_back ( "PAW_PBENd_306Sep2000"  )

◆ push_back() [2527/4950]

x species_pp_version push_back ( "Nd_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2528/4950]

x species_pp_AUID push_back ( "f1b130cfd3bdc974"  )

◆ push_back() [2529/4950]

x species_pp_groundstate_structure push_back ( "N/A_f1b130cfd3bdc974"  )

◆ push_back() [2530/4950]

x vEATOM push_back ( 932.  9211)

◆ push_back() [2531/4950]

x vTITEL push_back ( "PAW_PBENd08Apr2002"  )

◆ push_back() [2532/4950]

x species_pp_version push_back ( "Nd:PAW_PBE:08Apr2002"  )

◆ push_back() [2533/4950]

x species_pp_AUID push_back ( "81811d7c33a85a8b"  )

◆ push_back() [2534/4950]

x species_pp_groundstate_structure push_back ( "N/A_81811d7c33a85a8b"  )

◆ push_back() [2535/4950]

x vTITEL push_back ( "PAW_PBENe05Jan2001"  )

◆ push_back() [2536/4950]

x species_pp_version push_back ( "Ne:PAW_PBE:05Jan2001"  )

◆ push_back() [2537/4950]

x species_pp_AUID push_back ( "91b32db4af57705e"  )

◆ push_back() [2538/4950]

x vEATOM push_back ( 955.  3367)

◆ push_back() [2539/4950]

x vTITEL push_back ( "PAW_PBEN_h13Feb2001"  )

◆ push_back() [2540/4950]

x species_pp_version push_back ( "N_h:PAW_PBE:13Feb2001"  )

◆ push_back() [2541/4950]

x species_pp_AUID push_back ( "be869d8257082ad4"  )

◆ push_back() [2542/4950]

x vEATOM push_back ( 264.  5486)

◆ push_back() [2543/4950]

x vTITEL push_back ( "PAW_PBENi06Sep2000"  )

◆ push_back() [2544/4950]

x species_pp_version push_back ( "Ni:PAW_PBE:06Sep2000"  )

◆ push_back() [2545/4950]

x species_pp_AUID push_back ( "1dc196d6de4f6b37"  )

◆ push_back() [2546/4950]

x vEATOM push_back ( 1077.  9025)

◆ push_back() [2547/4950]

x vTITEL push_back ( "PAW_PBENi_pv06Sep2000"  )

◆ push_back() [2548/4950]

x species_pp_version push_back ( "Ni_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2549/4950]

x species_pp_AUID push_back ( "ead949d4e6fa93d1"  )

◆ push_back() [2550/4950]

x vEATOM push_back ( 3500.  3496)

◆ push_back() [2551/4950]

x vTITEL push_back ( "PAW_PBEN08Apr2002"  )

◆ push_back() [2552/4950]

x species_pp_version push_back ( "N:PAW_PBE:08Apr2002"  )

◆ push_back() [2553/4950]

x species_pp_AUID push_back ( "3cd4003f27559a49"  )

◆ push_back() [2554/4950]

x vTITEL push_back ( "PAW_PBENp06Sep2000"  )

◆ push_back() [2555/4950]

x species_pp_version push_back ( "Np:PAW_PBE:06Sep2000"  )

◆ push_back() [2556/4950]

x species_pp_AUID push_back ( "9c55e928259407ba"  )

◆ push_back() [2557/4950]

x species_pp_groundstate_structure push_back ( "N/A_9c55e928259407ba"  )

◆ push_back() [2558/4950]

x vEATOM push_back ( 1659.  396)

◆ push_back() [2559/4950]

x vTITEL push_back ( "PAW_PBENp_s06Sep2000"  )

◆ push_back() [2560/4950]

x species_pp_version push_back ( "Np_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2561/4950]

x species_pp_AUID push_back ( "4680e4b29fa74e14"  )

◆ push_back() [2562/4950]

x species_pp_groundstate_structure push_back ( "N/A_4680e4b29fa74e14"  )

◆ push_back() [2563/4950]

x vTITEL push_back ( "PAW_PBEN_s07Sep2000"  )

◆ push_back() [2564/4950]

x species_pp_version push_back ( "N_s:PAW_PBE:07Sep2000"  )

◆ push_back() [2565/4950]

x species_pp_AUID push_back ( "5008481c6eeefc15"  )

◆ push_back() [2566/4950]

x species_pp_groundstate_structure push_back ( "N/A_5008481c6eeefc15"  )

◆ push_back() [2567/4950]

x vTITEL push_back ( "PAW_PBEO_h20Dec2001"  )

◆ push_back() [2568/4950]

x species_pp_version push_back ( "O_h:PAW_PBE:20Dec2001"  )

◆ push_back() [2569/4950]

x species_pp_AUID push_back ( "60ee78e0c6ceac3d"  )

◆ push_back() [2570/4950]

x vTITEL push_back ( "PAW_PBEO08Apr2002"  )

◆ push_back() [2571/4950]

x species_pp_version push_back ( "O:PAW_PBE:08Apr2002"  )

◆ push_back() [2572/4950]

x species_pp_AUID push_back ( "85ded82734544fa9"  )

◆ push_back() [2573/4950]

x vTITEL push_back ( "PAW_PBEO_s07Sep2000"  )

◆ push_back() [2574/4950]

x species_pp_version push_back ( "O_s:PAW_PBE:07Sep2000"  )

◆ push_back() [2575/4950]

x species_pp_AUID push_back ( "847e34315251cef5"  )

◆ push_back() [2576/4950]

x vTITEL push_back ( "PAW_PBEOs17Jan2003"  )

◆ push_back() [2577/4950]

x species_pp_version push_back ( "Os:PAW_PBE:17Jan2003"  )

◆ push_back() [2578/4950]

x species_pp_AUID push_back ( "b1954be3210262f1"  )

◆ push_back() [2579/4950]

x vTITEL push_back ( "PAW_PBEOs_pv20Jan2003"  )

◆ push_back() [2580/4950]

x species_pp_version push_back ( "Os_pv:PAW_PBE:20Jan2003"  )

◆ push_back() [2581/4950]

x species_pp_AUID push_back ( "216ecda62b9b32bf"  )

◆ push_back() [2582/4950]

x vTITEL push_back ( "PAW_PBEPa07Sep2000"  )

◆ push_back() [2583/4950]

x species_pp_version push_back ( "Pa:PAW_PBE:07Sep2000"  )

◆ push_back() [2584/4950]

x species_pp_AUID push_back ( "27da4b4adce26e4b"  )

◆ push_back() [2585/4950]

x species_pp_groundstate_structure push_back ( "N/A_27da4b4adce26e4b"  )

◆ push_back() [2586/4950]

x vEATOM push_back ( 1178.  644)

◆ push_back() [2587/4950]

x vTITEL push_back ( "PAW_PBEPa_s07Sep2000"  )

◆ push_back() [2588/4950]

x species_pp_version push_back ( "Pa_s:PAW_PBE:07Sep2000"  )

◆ push_back() [2589/4950]

x species_pp_AUID push_back ( "bb76a0627c585a16"  )

◆ push_back() [2590/4950]

x species_pp_groundstate_structure push_back ( "N/A_bb76a0627c585a16"  )

◆ push_back() [2591/4950]

x vEATOM push_back ( 780.  9026)

◆ push_back() [2592/4950]

x vTITEL push_back ( "PAW_PBEPb_d06Sep2000"  )

◆ push_back() [2593/4950]

x species_pp_version push_back ( "Pb_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2594/4950]

x species_pp_AUID push_back ( "0e47cf73a95cbfc2"  )

◆ push_back() [2595/4950]

x vTITEL push_back ( "PAW_PBEPb08Apr2002"  )

◆ push_back() [2596/4950]

x species_pp_version push_back ( "Pb:PAW_PBE:08Apr2002"  )

◆ push_back() [2597/4950]

x species_pp_AUID push_back ( "2f64d0d7f1c21e2c"  )

◆ push_back() [2598/4950]

x vEATOM push_back ( 96.  9868)

◆ push_back() [2599/4950]

x vTITEL push_back ( "PAW_PBEPd05Jan2001"  )

◆ push_back() [2600/4950]

x species_pp_version push_back ( "Pd:PAW_PBE:05Jan2001"  )

◆ push_back() [2601/4950]

x species_pp_AUID push_back ( "6ade515555bfea29"  )

◆ push_back() [2602/4950]

x vEATOM push_back ( 809.  7532)

◆ push_back() [2603/4950]

x vTITEL push_back ( "PAW_PBEPd_pv06Sep2000"  )

◆ push_back() [2604/4950]

x species_pp_version push_back ( "Pd_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2605/4950]

x species_pp_AUID push_back ( "4af3f66c14a34cee"  )

◆ push_back() [2606/4950]

x vEATOM push_back ( 2620.  5408)

◆ push_back() [2607/4950]

x vTITEL push_back ( "PAW_PBEP_h08Apr2002"  )

◆ push_back() [2608/4950]

x species_pp_version push_back ( "P_h:PAW_PBE:08Apr2002"  )

◆ push_back() [2609/4950]

x species_pp_AUID push_back ( "9cda207b69733787"  )

◆ push_back() [2610/4950]

x species_pp_groundstate_structure push_back ( "N/A_9cda207b69733787"  )

◆ push_back() [2611/4950]

x vTITEL push_back ( "PAW_PBEPm_307Sep2000"  )

◆ push_back() [2612/4950]

x species_pp_version push_back ( "Pm_3:PAW_PBE:07Sep2000"  )

◆ push_back() [2613/4950]

x species_pp_AUID push_back ( "943dbef9dfbc821c"  )

◆ push_back() [2614/4950]

x species_pp_groundstate_structure push_back ( "N/A_943dbef9dfbc821c"  )

◆ push_back() [2615/4950]

x vTITEL push_back ( "PAW_PBEPm08Apr2002"  )

◆ push_back() [2616/4950]

x species_pp_version push_back ( "Pm:PAW_PBE:08Apr2002"  )

◆ push_back() [2617/4950]

x species_pp_AUID push_back ( "a66df35b1ed2d552"  )

◆ push_back() [2618/4950]

x species_pp_groundstate_structure push_back ( "N/A_a66df35b1ed2d552"  )

◆ push_back() [2619/4950]

x vEATOM push_back ( 1870.  3302)

◆ push_back() [2620/4950]

x vTITEL push_back ( "PAW_PBEP17Jan2003"  )

◆ push_back() [2621/4950]

x species_pp_version push_back ( "P:PAW_PBE:17Jan2003"  )

◆ push_back() [2622/4950]

x species_pp_AUID push_back ( "0df9932192e3546b"  )

◆ push_back() [2623/4950]

x vTITEL push_back ( "PAW_PBEPr_307Sep2000"  )

◆ push_back() [2624/4950]

x species_pp_version push_back ( "Pr_3:PAW_PBE:07Sep2000"  )

◆ push_back() [2625/4950]

x species_pp_AUID push_back ( "710966b82dcf78d7"  )

◆ push_back() [2626/4950]

x species_pp_groundstate_structure push_back ( "N/A_710966b82dcf78d7"  )

◆ push_back() [2627/4950]

x vEATOM push_back ( 911.  7548)

◆ push_back() [2628/4950]

x vTITEL push_back ( "PAW_PBEPr08Apr2002"  )

◆ push_back() [2629/4950]

x species_pp_version push_back ( "Pr:PAW_PBE:08Apr2002"  )

◆ push_back() [2630/4950]

x species_pp_AUID push_back ( "82dbd5ee06192a4c"  )

◆ push_back() [2631/4950]

x species_pp_groundstate_structure push_back ( "N/A_82dbd5ee06192a4c"  )

◆ push_back() [2632/4950]

x vTITEL push_back ( "PAW_PBEPt05Jan2001"  )

◆ push_back() [2633/4950]

x species_pp_version push_back ( "Pt:PAW_PBE:05Jan2001"  )

◆ push_back() [2634/4950]

x species_pp_AUID push_back ( "59081d68fabd053c"  )

◆ push_back() [2635/4950]

x vEATOM push_back ( 729.  1171)

◆ push_back() [2636/4950]

x vTITEL push_back ( "PAW_PBEPu06Sep2000"  )

◆ push_back() [2637/4950]

x species_pp_version push_back ( "Pu:PAW_PBE:06Sep2000"  )

◆ push_back() [2638/4950]

x species_pp_AUID push_back ( "d32953d7b405dbec"  )

◆ push_back() [2639/4950]

x species_pp_groundstate_structure push_back ( "N/A_d32953d7b405dbec"  )

◆ push_back() [2640/4950]

x vEATOM push_back ( 1947.  0285)

◆ push_back() [2641/4950]

x vTITEL push_back ( "PAW_PBEPu_s06Sep2000"  )

◆ push_back() [2642/4950]

x species_pp_version push_back ( "Pu_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2643/4950]

x species_pp_AUID push_back ( "28655ed16333122f"  )

◆ push_back() [2644/4950]

x species_pp_groundstate_structure push_back ( "N/A_28655ed16333122f"  )

◆ push_back() [2645/4950]

x vTITEL push_back ( "PAW_PBERb_pv06Sep2000"  )

◆ push_back() [2646/4950]

x species_pp_version push_back ( "Rb_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2647/4950]

x species_pp_AUID push_back ( "a8be193d6a4c1039"  )

◆ push_back() [2648/4950]

x species_pp_groundstate_structure push_back ( "N/A_a8be193d6a4c1039"  )

◆ push_back() [2649/4950]

x vTITEL push_back ( "PAW_PBERb_sv06Sep2000"  )

◆ push_back() [2650/4950]

x species_pp_version push_back ( "Rb_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2651/4950]

x species_pp_AUID push_back ( "4a3726ab01a44892"  )

◆ push_back() [2652/4950]

x vTITEL push_back ( "PAW_PBERe17Jan2003"  )

◆ push_back() [2653/4950]

x species_pp_version push_back ( "Re:PAW_PBE:17Jan2003"  )

◆ push_back() [2654/4950]

x species_pp_AUID push_back ( "e5efc178b4648996"  )

◆ push_back() [2655/4950]

x vEATOM push_back ( 299.  6589)

◆ push_back() [2656/4950]

x vTITEL push_back ( "PAW_PBERe_pv06Sep2000"  )

◆ push_back() [2657/4950]

x species_pp_version push_back ( "Re_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2658/4950]

x species_pp_AUID push_back ( "d72276b27490b853"  )

◆ push_back() [2659/4950]

x vEATOM push_back ( 1503.  6655)

◆ push_back() [2660/4950]

x vTITEL push_back ( "PAW_PBERh06Sep2000"  )

◆ push_back() [2661/4950]

x species_pp_version push_back ( "Rh:PAW_PBE:06Sep2000"  )

◆ push_back() [2662/4950]

x species_pp_AUID push_back ( "e06760ebe9e0e518"  )

◆ push_back() [2663/4950]

x vEATOM push_back ( 616.  5493)

◆ push_back() [2664/4950]

x vTITEL push_back ( "PAW_PBERh_pv06Sep2000"  )

◆ push_back() [2665/4950]

x species_pp_version push_back ( "Rh_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2666/4950]

x species_pp_AUID push_back ( "b1547f3221c0c660"  )

◆ push_back() [2667/4950]

x vEATOM push_back ( 2225.  6185)

◆ push_back() [2668/4950]

x vTITEL push_back ( "PAW_PBERu06Sep2000"  )

◆ push_back() [2669/4950]

x species_pp_version push_back ( "Ru:PAW_PBE:06Sep2000"  )

◆ push_back() [2670/4950]

x species_pp_AUID push_back ( "e2e4aaaa46da8131"  )

◆ push_back() [2671/4950]

x vEATOM push_back ( 454.  9988)

◆ push_back() [2672/4950]

x vTITEL push_back ( "PAW_PBERu_pv06Sep2000"  )

◆ push_back() [2673/4950]

x species_pp_version push_back ( "Ru_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2674/4950]

x species_pp_AUID push_back ( "a3d039d8d88a4a86"  )

◆ push_back() [2675/4950]

x vEATOM push_back ( 1872.  7511)

◆ push_back() [2676/4950]

x vTITEL push_back ( "PAW_PBESb06Sep2000"  )

◆ push_back() [2677/4950]

x species_pp_version push_back ( "Sb:PAW_PBE:06Sep2000"  )

◆ push_back() [2678/4950]

x species_pp_AUID push_back ( "6ec70613ee3528b2"  )

◆ push_back() [2679/4950]

x vEATOM push_back ( 149.  8037)

◆ push_back() [2680/4950]

x vTITEL push_back ( "PAW_PBESc_sv07Sep2000"  )

◆ push_back() [2681/4950]

x species_pp_version push_back ( "Sc_sv:PAW_PBE:07Sep2000"  )

◆ push_back() [2682/4950]

x species_pp_AUID push_back ( "4b48722b5ae8f9e9"  )

◆ push_back() [2683/4950]

x vEATOM push_back ( 1272.  8233)

◆ push_back() [2684/4950]

x vTITEL push_back ( "PAW_PBESe06Sep2000"  )

◆ push_back() [2685/4950]

x species_pp_version push_back ( "Se:PAW_PBE:06Sep2000"  )

◆ push_back() [2686/4950]

x species_pp_AUID push_back ( "40060a482797271e"  )

◆ push_back() [2687/4950]

x species_pp_groundstate_structure push_back ( "A8"  )

◆ push_back() [2688/4950]

x vEATOM push_back ( 256.  9644)

◆ push_back() [2689/4950]

x vTITEL push_back ( "PAW_PBES_h08Apr2002"  )

◆ push_back() [2690/4950]

x species_pp_version push_back ( "S_h:PAW_PBE:08Apr2002"  )

◆ push_back() [2691/4950]

x species_pp_AUID push_back ( "bc8c0a7b1c42fa87"  )

◆ push_back() [2692/4950]

x species_pp_groundstate_structure push_back ( "N/A_bc8c0a7b1c42fa87"  )

◆ push_back() [2693/4950]

x vTITEL push_back ( "PAW_PBESi_h08Apr2002"  )

◆ push_back() [2694/4950]

x species_pp_version push_back ( "Si_h:PAW_PBE:08Apr2002"  )

◆ push_back() [2695/4950]

x species_pp_AUID push_back ( "5d164d220fd7ceee"  )

◆ push_back() [2696/4950]

x vTITEL push_back ( "PAW_PBESi05Jan2001"  )

◆ push_back() [2697/4950]

x species_pp_version push_back ( "Si:PAW_PBE:05Jan2001"  )

◆ push_back() [2698/4950]

x species_pp_AUID push_back ( "3ea77bd2a2af2ad4"  )

◆ push_back() [2699/4950]

x vTITEL push_back ( "PAW_PBESm_307Sep2000"  )

◆ push_back() [2700/4950]

x species_pp_version push_back ( "Sm_3:PAW_PBE:07Sep2000"  )

◆ push_back() [2701/4950]

x species_pp_AUID push_back ( "d3011b597251aacb"  )

◆ push_back() [2702/4950]

x vEATOM push_back ( 973.  0754)

◆ push_back() [2703/4950]

x vTITEL push_back ( "PAW_PBESm08Apr2002"  )

◆ push_back() [2704/4950]

x species_pp_version push_back ( "Sm:PAW_PBE:08Apr2002"  )

◆ push_back() [2705/4950]

x species_pp_AUID push_back ( "e892f33edd3901b8"  )

◆ push_back() [2706/4950]

x species_pp_groundstate_structure push_back ( "N/A_e892f33edd3901b8"  )

◆ push_back() [2707/4950]

x vEATOM push_back ( 2218.  7933)

◆ push_back() [2708/4950]

x vTITEL push_back ( "PAW_PBESn_d06Sep2000"  )

◆ push_back() [2709/4950]

x species_pp_version push_back ( "Sn_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2710/4950]

x species_pp_AUID push_back ( "ec3f84d587dd2653"  )

◆ push_back() [2711/4950]

x vEATOM push_back ( 1893.  0782)

◆ push_back() [2712/4950]

x vTITEL push_back ( "PAW_PBESn08Apr2002"  )

◆ push_back() [2713/4950]

x species_pp_version push_back ( "Sn:PAW_PBE:08Apr2002"  )

◆ push_back() [2714/4950]

x species_pp_AUID push_back ( "37c5d78c5699ee73"  )

◆ push_back() [2715/4950]

x vTITEL push_back ( "PAW_PBES17Jan2003"  )

◆ push_back() [2716/4950]

x species_pp_version push_back ( "S:PAW_PBE:17Jan2003"  )

◆ push_back() [2717/4950]

x species_pp_AUID push_back ( "e75b388c58799a1c"  )

◆ push_back() [2718/4950]

x species_pp_groundstate_structure push_back ( "A16"  )

◆ push_back() [2719/4950]

x vTITEL push_back ( "PAW_PBESr_sv07Sep2000"  )

◆ push_back() [2720/4950]

x species_pp_version push_back ( "Sr_sv:PAW_PBE:07Sep2000"  )

◆ push_back() [2721/4950]

x species_pp_AUID push_back ( "68b7a60c49c97739"  )

◆ push_back() [2722/4950]

x vEATOM push_back ( 842.  4562)

◆ push_back() [2723/4950]

x vTITEL push_back ( "PAW_PBETa17Jan2003"  )

◆ push_back() [2724/4950]

x species_pp_version push_back ( "Ta:PAW_PBE:17Jan2003"  )

◆ push_back() [2725/4950]

x species_pp_AUID push_back ( "d83777bdbc002be9"  )

◆ push_back() [2726/4950]

x vEATOM push_back ( 130.  6506)

◆ push_back() [2727/4950]

x vTITEL push_back ( "PAW_PBETa_pv07Sep2000"  )

◆ push_back() [2728/4950]

x species_pp_version push_back ( "Ta_pv:PAW_PBE:07Sep2000"  )

◆ push_back() [2729/4950]

x species_pp_AUID push_back ( "926ce9924f7a5fd2"  )

◆ push_back() [2730/4950]

x vEATOM push_back ( 1045.  8051)

◆ push_back() [2731/4950]

x vTITEL push_back ( "PAW_PBETb_306Sep2000"  )

◆ push_back() [2732/4950]

x species_pp_version push_back ( "Tb_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2733/4950]

x species_pp_AUID push_back ( "df41de2ac6afa1b3"  )

◆ push_back() [2734/4950]

x species_pp_groundstate_structure push_back ( "N/A_df41de2ac6afa1b3"  )

◆ push_back() [2735/4950]

x vEATOM push_back ( 640.  517)

◆ push_back() [2736/4950]

x vTITEL push_back ( "PAW_PBETc17Jan2003"  )

◆ push_back() [2737/4950]

x species_pp_version push_back ( "Tc:PAW_PBE:17Jan2003"  )

◆ push_back() [2738/4950]

x species_pp_AUID push_back ( "aabb0d26abfc5599"  )

◆ push_back() [2739/4950]

x vEATOM push_back ( 322.  7317)

◆ push_back() [2740/4950]

x vTITEL push_back ( "PAW_PBETc_pv06Sep2000"  )

◆ push_back() [2741/4950]

x species_pp_version push_back ( "Tc_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2742/4950]

x species_pp_AUID push_back ( "c33964edb4f74ebf"  )

◆ push_back() [2743/4950]

x vEATOM push_back ( 1559.  5964)

◆ push_back() [2744/4950]

x vTITEL push_back ( "PAW_PBETe08Apr2002"  )

◆ push_back() [2745/4950]

x species_pp_version push_back ( "Te:PAW_PBE:08Apr2002"  )

◆ push_back() [2746/4950]

x species_pp_AUID push_back ( "96c99e8488c592ae"  )

◆ push_back() [2747/4950]

x vTITEL push_back ( "PAW_PBETh07Sep2000"  )

◆ push_back() [2748/4950]

x species_pp_version push_back ( "Th:PAW_PBE:07Sep2000"  )

◆ push_back() [2749/4950]

x species_pp_AUID push_back ( "fb9c58a1464d0eff"  )

◆ push_back() [2750/4950]

x species_pp_groundstate_structure push_back ( "N/A_fb9c58a1464d0eff"  )

◆ push_back() [2751/4950]

x vEATOM push_back ( 983.  4988)

◆ push_back() [2752/4950]

x vTITEL push_back ( "PAW_PBETh_s06Sep2000"  )

◆ push_back() [2753/4950]

x species_pp_version push_back ( "Th_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2754/4950]

x species_pp_AUID push_back ( "78f7995fc479457d"  )

◆ push_back() [2755/4950]

x species_pp_groundstate_structure push_back ( "N/A_78f7995fc479457d"  )

◆ push_back() [2756/4950]

x vTITEL push_back ( "PAW_PBETi08Apr2002"  )

◆ push_back() [2757/4950]

x species_pp_version push_back ( "Ti:PAW_PBE:08Apr2002"  )

◆ push_back() [2758/4950]

x species_pp_AUID push_back ( "e18697ab9588a353"  )

◆ push_back() [2759/4950]

x vTITEL push_back ( "PAW_PBETi_pv07Sep2000"  )

◆ push_back() [2760/4950]

x species_pp_version push_back ( "Ti_pv:PAW_PBE:07Sep2000"  )

◆ push_back() [2761/4950]

x species_pp_AUID push_back ( "3f1fd5d5748fffbc"  )

◆ push_back() [2762/4950]

x vEATOM push_back ( 1042.  3781)

◆ push_back() [2763/4950]

x vTITEL push_back ( "PAW_PBETi_sv07Sep2000"  )

◆ push_back() [2764/4950]

x species_pp_version push_back ( "Ti_sv:PAW_PBE:07Sep2000"  )

◆ push_back() [2765/4950]

x species_pp_AUID push_back ( "9cdd346558c528c6"  )

◆ push_back() [2766/4950]

x vEATOM push_back ( 1587.  5048)

◆ push_back() [2767/4950]

x vTITEL push_back ( "PAW_PBETl_d06Sep2000"  )

◆ push_back() [2768/4950]

x species_pp_version push_back ( "Tl_d:PAW_PBE:06Sep2000"  )

◆ push_back() [2769/4950]

x species_pp_AUID push_back ( "f473cbb4831e0bc0"  )

◆ push_back() [2770/4950]

x vEATOM push_back ( 1391.  5348)

◆ push_back() [2771/4950]

x vTITEL push_back ( "PAW_PBETl08Apr2002"  )

◆ push_back() [2772/4950]

x species_pp_version push_back ( "Tl:PAW_PBE:08Apr2002"  )

◆ push_back() [2773/4950]

x species_pp_AUID push_back ( "b88a3147de55f4a8"  )

◆ push_back() [2774/4950]

x vTITEL push_back ( "PAW_PBETm_306Sep2000"  )

◆ push_back() [2775/4950]

x species_pp_version push_back ( "Tm_3:PAW_PBE:06Sep2000"  )

◆ push_back() [2776/4950]

x species_pp_AUID push_back ( "2dcbb00353aaad28"  )

◆ push_back() [2777/4950]

x species_pp_groundstate_structure push_back ( "N/A_2dcbb00353aaad28"  )

◆ push_back() [2778/4950]

x vTITEL push_back ( "PAW_PBETm06Sep2000"  )

◆ push_back() [2779/4950]

x species_pp_version push_back ( "Tm:PAW_PBE:06Sep2000"  )

◆ push_back() [2780/4950]

x species_pp_AUID push_back ( "766b44cce10b0315"  )

◆ push_back() [2781/4950]

x species_pp_groundstate_structure push_back ( "N/A_766b44cce10b0315"  )

◆ push_back() [2782/4950]

x vEATOM push_back ( 5985.  6925)

◆ push_back() [2783/4950]

x vTITEL push_back ( "PAW_PBEU06Sep2000"  )

◆ push_back() [2784/4950]

x species_pp_version push_back ( "U:PAW_PBE:06Sep2000"  )

◆ push_back() [2785/4950]

x species_pp_AUID push_back ( "2f0fba94372190f4"  )

◆ push_back() [2786/4950]

x species_pp_groundstate_structure push_back ( "N/A_2f0fba94372190f4"  )

◆ push_back() [2787/4950]

x vEATOM push_back ( 1403.  8218)

◆ push_back() [2788/4950]

x vTITEL push_back ( "PAW_PBEU_s06Sep2000"  )

◆ push_back() [2789/4950]

x species_pp_version push_back ( "U_s:PAW_PBE:06Sep2000"  )

◆ push_back() [2790/4950]

x species_pp_AUID push_back ( "587b578e01b9d4dd"  )

◆ push_back() [2791/4950]

x species_pp_groundstate_structure push_back ( "N/A_587b578e01b9d4dd"  )

◆ push_back() [2792/4950]

x vTITEL push_back ( "PAW_PBEV08Apr2002"  )

◆ push_back() [2793/4950]

x species_pp_version push_back ( "V:PAW_PBE:08Apr2002"  )

◆ push_back() [2794/4950]

x species_pp_AUID push_back ( "183846be5b03c64d"  )

◆ push_back() [2795/4950]

x vTITEL push_back ( "PAW_PBEV_pv07Sep2000"  )

◆ push_back() [2796/4950]

x species_pp_version push_back ( "V_pv:PAW_PBE:07Sep2000"  )

◆ push_back() [2797/4950]

x species_pp_AUID push_back ( "b7d3211b63a6261e"  )

◆ push_back() [2798/4950]

x vEATOM push_back ( 1321.  3402)

◆ push_back() [2799/4950]

x vTITEL push_back ( "PAW_PBEV_sv07Sep2000"  )

◆ push_back() [2800/4950]

x species_pp_version push_back ( "V_sv:PAW_PBE:07Sep2000"  )

◆ push_back() [2801/4950]

x species_pp_AUID push_back ( "94da8dda3e65c762"  )

◆ push_back() [2802/4950]

x vEATOM push_back ( 1951.  3925)

◆ push_back() [2803/4950]

x vTITEL push_back ( "PAW_PBEW08Apr2002"  )

◆ push_back() [2804/4950]

x species_pp_version push_back ( "W:PAW_PBE:08Apr2002"  )

◆ push_back() [2805/4950]

x species_pp_AUID push_back ( "1febde78746c14e4"  )

◆ push_back() [2806/4950]

x vTITEL push_back ( "PAW_PBEW_pv06Sep2000"  )

◆ push_back() [2807/4950]

x species_pp_version push_back ( "W_pv:PAW_PBE:06Sep2000"  )

◆ push_back() [2808/4950]

x species_pp_AUID push_back ( "cad81c4b63d2d96e"  )

◆ push_back() [2809/4950]

x vEATOM push_back ( 1260.  0376)

◆ push_back() [2810/4950]

x vTITEL push_back ( "PAW_PBEXe07Sep2000"  )

◆ push_back() [2811/4950]

x species_pp_version push_back ( "Xe:PAW_PBE:07Sep2000"  )

◆ push_back() [2812/4950]

x species_pp_AUID push_back ( "cde8ed26c95905b5"  )

◆ push_back() [2813/4950]

x species_pp_groundstate_structure push_back ( "isolated"  )

◆ push_back() [2814/4950]

x vTITEL push_back ( "PAW_PBEYb_206Sep2000"  )

◆ push_back() [2815/4950]

x species_pp_version push_back ( "Yb_2:PAW_PBE:06Sep2000"  )

◆ push_back() [2816/4950]

x species_pp_AUID push_back ( "4e35fa207bf4aaa9"  )

◆ push_back() [2817/4950]

x vTITEL push_back ( "PAW_PBEYb24Feb2003"  )

◆ push_back() [2818/4950]

x species_pp_version push_back ( "Yb:PAW_PBE:24Feb2003"  )

◆ push_back() [2819/4950]

x species_pp_AUID push_back ( "de1c22a384a8d945"  )

◆ push_back() [2820/4950]

x vEATOM push_back ( 6750.  7881)

◆ push_back() [2821/4950]

x vTITEL push_back ( "PAW_PBEY_sv06Sep2000"  )

◆ push_back() [2822/4950]

x species_pp_version push_back ( "Y_sv:PAW_PBE:06Sep2000"  )

◆ push_back() [2823/4950]

x species_pp_AUID push_back ( "b07bf0a656aa22bc"  )

◆ push_back() [2824/4950]

x vTITEL push_back ( "PAW_PBEZn06Sep2000"  )

◆ push_back() [2825/4950]

x species_pp_version push_back ( "Zn:PAW_PBE:06Sep2000"  )

◆ push_back() [2826/4950]

x species_pp_AUID push_back ( "d4ad14ef9da00329"  )

◆ push_back() [2827/4950]

x vEATOM push_back ( 1749.  0928)

◆ push_back() [2828/4950]

x vTITEL push_back ( "PAW_PBEZr08Apr2002"  )

◆ push_back() [2829/4950]

x species_pp_version push_back ( "Zr:PAW_PBE:08Apr2002"  )

◆ push_back() [2830/4950]

x species_pp_AUID push_back ( "014ba38906f94787"  )

◆ push_back() [2831/4950]

x vTITEL push_back ( "PAW_PBEZr_sv07Sep2000"  )

◆ push_back() [2832/4950]

x species_pp_version push_back ( "Zr_sv:PAW_PBE:07Sep2000"  )

◆ push_back() [2833/4950]

x species_pp_AUID push_back ( "8f81b69844f3963f"  )

◆ push_back() [2834/4950]

x vEATOM push_back ( 1283.  3934)

◆ push_back() [2835/4950]

x species_pp_AUID push_back ( "5ece90a899819730"  )

◆ push_back() [2836/4950]

x vTITEL push_back ( "PAWAg_GW06Mar2008"  )

◆ push_back() [2837/4950]

x species_pp push_back ( "Ag_GW"  )

◆ push_back() [2838/4950]

x species_pp_version push_back ( "Ag_GW:PAW_LDA:06Mar2008"  )

◆ push_back() [2839/4950]

x species_pp_AUID push_back ( "b38744d8573af1ff"  )

◆ push_back() [2840/4950]

x vTITEL push_back ( "PAWAg06Sep2000"  )

◆ push_back() [2841/4950]

x species_pp_version push_back ( "Ag:PAW_LDA:06Sep2000"  )

◆ push_back() [2842/4950]

x species_pp_AUID push_back ( "e7b3b0854117d479"  )

◆ push_back() [2843/4950]

x vTITEL push_back ( "PAWAg_pv09Dec2005"  )

◆ push_back() [2844/4950]

x species_pp push_back ( "Ag_pv"  )

◆ push_back() [2845/4950]

x species_pp_version push_back ( "Ag_pv:PAW_LDA:09Dec2005"  )

◆ push_back() [2846/4950]

x species_pp_AUID push_back ( "6f991220b199a503"  )

◆ push_back() [2847/4950]

x vEATOM push_back ( 3065.  2391)

◆ push_back() [2848/4950]

x vTITEL push_back ( "PAWAg_sv_GW05Dec2013"  )

◆ push_back() [2849/4950]

x species_pp push_back ( "Ag_sv_GW"  )

◆ push_back() [2850/4950]

x species_pp_version push_back ( "Ag_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [2851/4950]

x species_pp_AUID push_back ( "4c76b3914a101101"  )

◆ push_back() [2852/4950]

x vEATOM push_back ( 4028.  8907)

◆ push_back() [2853/4950]

x vTITEL push_back ( "PAWAl_GW19Mar2012"  )

◆ push_back() [2854/4950]

x species_pp push_back ( "Al_GW"  )

◆ push_back() [2855/4950]

x species_pp_version push_back ( "Al_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [2856/4950]

x species_pp_AUID push_back ( "f22666edc17781c8"  )

◆ push_back() [2857/4950]

x species_pp_AUID push_back ( "81d77d1303d46a24"  )

◆ push_back() [2858/4950]

x vTITEL push_back ( "PAWAl_sv_GW2Feb2008"  )

◆ push_back() [2859/4950]

x species_pp push_back ( "Al_sv_GW"  )

◆ push_back() [2860/4950]

x species_pp_version push_back ( "Al_sv_GW:PAW_LDA:2Feb2008"  )

◆ push_back() [2861/4950]

x species_pp_AUID push_back ( "2510ee85c48b48c2"  )

◆ push_back() [2862/4950]

x vEATOM push_back ( 2212.  9049)

◆ push_back() [2863/4950]

x vTITEL push_back ( "PAWAm08May2007"  )

◆ push_back() [2864/4950]

x species_pp push_back ( "Am"  )

◆ push_back() [2865/4950]

x species_Z push_back ( 95  )

◆ push_back() [2866/4950]

x species_pp_version push_back ( "Am:PAW_LDA:08May2007"  )

◆ push_back() [2867/4950]

x species_pp_AUID push_back ( "2848a491ae089973"  )

◆ push_back() [2868/4950]

x species_pp_groundstate_structure push_back ( "N/A_2848a491ae089973"  )

◆ push_back() [2869/4950]

x vEATOM push_back ( 2275.  3982)

◆ push_back() [2870/4950]

x vTITEL push_back ( "PAWAr_GW21Aug2013"  )

◆ push_back() [2871/4950]

x species_pp push_back ( "Ar_GW"  )

◆ push_back() [2872/4950]

x species_pp_version push_back ( "Ar_GW:PAW_LDA:21Aug2013"  )

◆ push_back() [2873/4950]

x species_pp_AUID push_back ( "33d4ba6d5d91a625"  )

◆ push_back() [2874/4950]

x species_pp_AUID push_back ( "4dc09f7b5e65769e"  )

◆ push_back() [2875/4950]

x vTITEL push_back ( "PAWAs_d11Apr2003"  )

◆ push_back() [2876/4950]

x species_pp push_back ( "As_d"  )

◆ push_back() [2877/4950]

x species_pp_version push_back ( "As_d:PAW_LDA:11Apr2003"  )

◆ push_back() [2878/4950]

x species_pp_AUID push_back ( "f2e9c596fd4d093b"  )

◆ push_back() [2879/4950]

x species_pp_groundstate_structure push_back ( "N/A_f2e9c596fd4d093b"  )

◆ push_back() [2880/4950]

x vEATOM push_back ( 3100.  256)

◆ push_back() [2881/4950]

x vTITEL push_back ( "PAWAs_GW12Mar2012"  )

◆ push_back() [2882/4950]

x species_pp push_back ( "As_GW"  )

◆ push_back() [2883/4950]

x species_pp_version push_back ( "As_GW:PAW_LDA:12Mar2012"  )

◆ push_back() [2884/4950]

x species_pp_AUID push_back ( "4f1260ea8e0fc3f1"  )

◆ push_back() [2885/4950]

x species_pp_groundstate_structure push_back ( "N/A_4f1260ea8e0fc3f1"  )

◆ push_back() [2886/4950]

x vTITEL push_back ( "PAWAs15Mar2012"  )

◆ push_back() [2887/4950]

x species_pp_version push_back ( "As:PAW_LDA:15Mar2012"  )

◆ push_back() [2888/4950]

x species_pp_AUID push_back ( "9e1da608eeaa32ab"  )

◆ push_back() [2889/4950]

x species_pp_groundstate_structure push_back ( "N/A_9e1da608eeaa32ab"  )

◆ push_back() [2890/4950]

x vTITEL push_back ( "PAWAs_sv_GW05Dec2013"  )

◆ push_back() [2891/4950]

x species_pp push_back ( "As_sv_GW"  )

◆ push_back() [2892/4950]

x species_pp_version push_back ( "As_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [2893/4950]

x species_pp_AUID push_back ( "e9c5864b31f9524e"  )

◆ push_back() [2894/4950]

x species_pp_groundstate_structure push_back ( "N/A_e9c5864b31f9524e"  )

◆ push_back() [2895/4950]

x vEATOM push_back ( 9060.  4507)

◆ push_back() [2896/4950]

x vTITEL push_back ( "PAWAt_d_GW14Apr2014"  )

◆ push_back() [2897/4950]

x species push_back ( "At"  )

◆ push_back() [2898/4950]

x species_Z push_back ( 85  )

◆ push_back() [2899/4950]

x species_pp push_back ( "At_d_GW"  )

◆ push_back() [2900/4950]

x species_pp_version push_back ( "At_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [2901/4950]

x species_pp_AUID push_back ( "a419a161c61cda8e"  )

◆ push_back() [2902/4950]

x species_pp_groundstate_structure push_back ( "N/A_a419a161c61cda8e"  )

◆ push_back() [2903/4950]

x vEATOM push_back ( 2647.  5701)

◆ push_back() [2904/4950]

x vTITEL push_back ( "PAWAt21May2007"  )

◆ push_back() [2905/4950]

x species_pp_version push_back ( "At:PAW_LDA:21May2007"  )

◆ push_back() [2906/4950]

x species_pp_AUID push_back ( "7398fac8fa7d919c"  )

◆ push_back() [2907/4950]

x species_pp_groundstate_structure push_back ( "N/A_7398fac8fa7d919c"  )

◆ push_back() [2908/4950]

x vEATOM push_back ( 309.  8965)

◆ push_back() [2909/4950]

x vTITEL push_back ( "PAWAt_sv_GW14Apr2014"  )

◆ push_back() [2910/4950]

x species_pp push_back ( "At_sv_GW"  )

◆ push_back() [2911/4950]

x species_pp_version push_back ( "At_sv_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [2912/4950]

x species_pp_AUID push_back ( "85aedb232db78ea8"  )

◆ push_back() [2913/4950]

x species_pp_groundstate_structure push_back ( "N/A_85aedb232db78ea8"  )

◆ push_back() [2914/4950]

x vEATOM push_back ( 7214.  8862)

◆ push_back() [2915/4950]

x vTITEL push_back ( "PAWAu_GW23Mar2010"  )

◆ push_back() [2916/4950]

x species_pp push_back ( "Au_GW"  )

◆ push_back() [2917/4950]

x species_pp_version push_back ( "Au_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [2918/4950]

x species_pp_AUID push_back ( "23da4a7f5773027a"  )

◆ push_back() [2919/4950]

x vTITEL push_back ( "PAWAu04Oct2007"  )

◆ push_back() [2920/4950]

x species_pp_version push_back ( "Au:PAW_LDA:04Oct2007"  )

◆ push_back() [2921/4950]

x species_pp_AUID push_back ( "6b9f89c79a20072f"  )

◆ push_back() [2922/4950]

x vTITEL push_back ( "PAWAu_sv_GW13Sep2013"  )

◆ push_back() [2923/4950]

x species_pp push_back ( "Au_sv_GW"  )

◆ push_back() [2924/4950]

x species_pp_version push_back ( "Au_sv_GW:PAW_LDA:13Sep2013"  )

◆ push_back() [2925/4950]

x species_pp_AUID push_back ( "101ad6a2dfb494d2"  )

◆ push_back() [2926/4950]

x vEATOM push_back ( 3751.  0915)

◆ push_back() [2927/4950]

x vTITEL push_back ( "PAWBa_sv_GW23Mar2010"  )

◆ push_back() [2928/4950]

x species_pp push_back ( "Ba_sv_GW"  )

◆ push_back() [2929/4950]

x species_pp_version push_back ( "Ba_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [2930/4950]

x species_pp_AUID push_back ( "8c5d3fb64ef288e5"  )

◆ push_back() [2931/4950]

x species_pp_AUID push_back ( "91a1497765539c20"  )

◆ push_back() [2932/4950]

x vTITEL push_back ( "PAWBe_GW04Mar2008"  )

◆ push_back() [2933/4950]

x species_pp push_back ( "Be_GW"  )

◆ push_back() [2934/4950]

x species_pp_version push_back ( "Be_GW:PAW_LDA:04Mar2008"  )

◆ push_back() [2935/4950]

x species_pp_AUID push_back ( "3c1c54261ede6034"  )

◆ push_back() [2936/4950]

x species_pp_AUID push_back ( "54e866d928c8d2d6"  )

◆ push_back() [2937/4950]

x vTITEL push_back ( "PAWBe_sv_GW31Mar2010"  )

◆ push_back() [2938/4950]

x species_pp push_back ( "Be_sv_GW"  )

◆ push_back() [2939/4950]

x species_pp_version push_back ( "Be_sv_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [2940/4950]

x species_pp_AUID push_back ( "22e3a620c52a6e6e"  )

◆ push_back() [2941/4950]

x vEATOM push_back ( 386.  058)

◆ push_back() [2942/4950]

x vTITEL push_back ( "PAWBe_sv26Mar2012"  )

◆ push_back() [2943/4950]

x species_pp_version push_back ( "Be_sv:PAW_LDA:26Mar2012"  )

◆ push_back() [2944/4950]

x species_pp_AUID push_back ( "90caaee04c9d7fc2"  )

◆ push_back() [2945/4950]

x vTITEL push_back ( "PAWB28Sep2005"  )

◆ push_back() [2946/4950]

x species_pp_version push_back ( "B:PAW_LDA:28Sep2005"  )

◆ push_back() [2947/4950]

x species_pp_AUID push_back ( "6e6fea73d5eda34d"  )

◆ push_back() [2948/4950]

x species_pp_groundstate_structure push_back ( "N/A_6e6fea73d5eda34d"  )

◆ push_back() [2949/4950]

x vTITEL push_back ( "PAWB_h06Feb2004"  )

◆ push_back() [2950/4950]

x species_pp_version push_back ( "B_h:PAW_LDA:06Feb2004"  )

◆ push_back() [2951/4950]

x species_pp_AUID push_back ( "a614d64449b426cc"  )

◆ push_back() [2952/4950]

x species_pp_groundstate_structure push_back ( "N/A_a614d64449b426cc"  )

◆ push_back() [2953/4950]

x vTITEL push_back ( "PAWBi_d_GW14Apr2014"  )

◆ push_back() [2954/4950]

x species_pp push_back ( "Bi_d_GW"  )

◆ push_back() [2955/4950]

x species_pp_version push_back ( "Bi_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [2956/4950]

x species_pp_AUID push_back ( "6ff048022a9fde91"  )

◆ push_back() [2957/4950]

x species_pp_groundstate_structure push_back ( "N/A_6ff048022a9fde91"  )

◆ push_back() [2958/4950]

x vEATOM push_back ( 2909.  8796)

◆ push_back() [2959/4950]

x species_pp_AUID push_back ( "390776fa5b735306"  )

◆ push_back() [2960/4950]

x species_pp_groundstate_structure push_back ( "N/A_390776fa5b735306"  )

◆ push_back() [2961/4950]

x vTITEL push_back ( "PAWBi_GW07Mar2011"  )

◆ push_back() [2962/4950]

x species_pp push_back ( "Bi_GW"  )

◆ push_back() [2963/4950]

x species_pp_version push_back ( "Bi_GW:PAW_LDA:07Mar2011"  )

◆ push_back() [2964/4950]

x species_pp_AUID push_back ( "e8a947e95826f497"  )

◆ push_back() [2965/4950]

x species_pp_groundstate_structure push_back ( "N/A_e8a947e95826f497"  )

◆ push_back() [2966/4950]

x species_pp_AUID push_back ( "ff95db53991b4f15"  )

◆ push_back() [2967/4950]

x species_pp_groundstate_structure push_back ( "N/A_ff95db53991b4f15"  )

◆ push_back() [2968/4950]

x vTITEL push_back ( "PAWBi_sv_GW14Apr2014"  )

◆ push_back() [2969/4950]

x species_pp push_back ( "Bi_sv_GW"  )

◆ push_back() [2970/4950]

x species_pp_version push_back ( "Bi_sv_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [2971/4950]

x species_pp_AUID push_back ( "e4097a630bd4de65"  )

◆ push_back() [2972/4950]

x species_pp_groundstate_structure push_back ( "N/A_e4097a630bd4de65"  )

◆ push_back() [2973/4950]

x vEATOM push_back ( 5906.  39)

◆ push_back() [2974/4950]

x vTITEL push_back ( "PAWB22Mar2012"  )

◆ push_back() [2975/4950]

x species_pp_version push_back ( "B:PAW_LDA:22Mar2012"  )

◆ push_back() [2976/4950]

x species_pp_AUID push_back ( "1afbe24658777f8c"  )

◆ push_back() [2977/4950]

x species_pp_groundstate_structure push_back ( "N/A_1afbe24658777f8c"  )

◆ push_back() [2978/4950]

x vTITEL push_back ( "PAWBr20Mar2012"  )

◆ push_back() [2979/4950]

x species_pp_version push_back ( "Br:PAW_LDA:20Mar2012"  )

◆ push_back() [2980/4950]

x species_pp_AUID push_back ( "35664065f3cbfb8e"  )

◆ push_back() [2981/4950]

x species_pp_groundstate_structure push_back ( "N/A_35664065f3cbfb8e"  )

◆ push_back() [2982/4950]

x species_pp_AUID push_back ( "9d8a56e8e056bd96"  )

◆ push_back() [2983/4950]

x species_pp_groundstate_structure push_back ( "N/A_9d8a56e8e056bd96"  )

◆ push_back() [2984/4950]

x vTITEL push_back ( "PAWBr_sv_GW21Nov2013"  )

◆ push_back() [2985/4950]

x species_pp push_back ( "Br_sv_GW"  )

◆ push_back() [2986/4950]

x species_pp_version push_back ( "Br_sv_GW:PAW_LDA:21Nov2013"  )

◆ push_back() [2987/4950]

x species_pp_AUID push_back ( "58d865c3bf168a56"  )

◆ push_back() [2988/4950]

x species_pp_groundstate_structure push_back ( "N/A_58d865c3bf168a56"  )

◆ push_back() [2989/4950]

x vEATOM push_back ( 11358.  9292)

◆ push_back() [2990/4950]

x species_pp_AUID push_back ( "fe82a39cbb583827"  )

◆ push_back() [2991/4950]

x species_pp_groundstate_structure push_back ( "N/A_fe82a39cbb583827"  )

◆ push_back() [2992/4950]

x species_pp_AUID push_back ( "57183fbccf86bacc"  )

◆ push_back() [2993/4950]

x vTITEL push_back ( "PAWCa_sv_GW31Mar2010"  )

◆ push_back() [2994/4950]

x species_pp push_back ( "Ca_sv_GW"  )

◆ push_back() [2995/4950]

x species_pp_version push_back ( "Ca_sv_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [2996/4950]

x species_pp_AUID push_back ( "1bd33f6e3f1fd4b0"  )

◆ push_back() [2997/4950]

x vEATOM push_back ( 1001.  6833)

◆ push_back() [2998/4950]

x species_pp_AUID push_back ( "ae8076243474d29f"  )

◆ push_back() [2999/4950]

x vTITEL push_back ( "PAWCd_f_GW18May2010"  )

◆ push_back() [3000/4950]

x species_pp push_back ( "Cd_f_GW"  )

◆ push_back() [3001/4950]

x species_pp_version push_back ( "Cd_f_GW:PAW_LDA:18May2010"  )

◆ push_back() [3002/4950]

x species_pp_AUID push_back ( "63ded7f1e98bd74e"  )

◆ push_back() [3003/4950]

x species_pp_AUID push_back ( "ab3a0195ab049ec8"  )

◆ push_back() [3004/4950]

x vTITEL push_back ( "PAWCd_sv_GW16Apr2014"  )

◆ push_back() [3005/4950]

x species_pp push_back ( "Cd_sv_GW"  )

◆ push_back() [3006/4950]

x species_pp_version push_back ( "Cd_sv_GW:PAW_LDA:16Apr2014"  )

◆ push_back() [3007/4950]

x species_pp_AUID push_back ( "74bf44fed86520ba"  )

◆ push_back() [3008/4950]

x vEATOM push_back ( 4595.  5941)

◆ push_back() [3009/4950]

x vTITEL push_back ( "PAWCe_GW26Mar2009"  )

◆ push_back() [3010/4950]

x species_pp push_back ( "Ce_GW"  )

◆ push_back() [3011/4950]

x species_pp_version push_back ( "Ce_GW:PAW_LDA:26Mar2009"  )

◆ push_back() [3012/4950]

x species_pp_AUID push_back ( "2374b2f08e4aadd7"  )

◆ push_back() [3013/4950]

x species_pp_groundstate_structure push_back ( "N/A_2374b2f08e4aadd7"  )

◆ push_back() [3014/4950]

x vTITEL push_back ( "PAWCe_h03Mar2005"  )

◆ push_back() [3015/4950]

x species_pp push_back ( "Ce_h"  )

◆ push_back() [3016/4950]

x species_pp_version push_back ( "Ce_h:PAW_LDA:03Mar2005"  )

◆ push_back() [3017/4950]

x species_pp_AUID push_back ( "2a3d7d6fc3c09784"  )

◆ push_back() [3018/4950]

x species_pp_groundstate_structure push_back ( "N/A_2a3d7d6fc3c09784"  )

◆ push_back() [3019/4950]

x vTITEL push_back ( "PAWCe26Mar2009"  )

◆ push_back() [3020/4950]

x species_pp_version push_back ( "Ce:PAW_LDA:26Mar2009"  )

◆ push_back() [3021/4950]

x species_pp_AUID push_back ( "caa092b943b29891"  )

◆ push_back() [3022/4950]

x species_pp_groundstate_structure push_back ( "N/A_caa092b943b29891"  )

◆ push_back() [3023/4950]

x vTITEL push_back ( "PAWC_GW_new19Mar2012"  )

◆ push_back() [3024/4950]

x species_pp push_back ( "C_GW_new"  )

◆ push_back() [3025/4950]

x species_pp_version push_back ( "C_GW_new:PAW_LDA:19Mar2012"  )

◆ push_back() [3026/4950]

x species_pp_AUID push_back ( "f272501da6fc3812"  )

◆ push_back() [3027/4950]

x species_pp_groundstate_structure push_back ( "N/A_f272501da6fc3812"  )

◆ push_back() [3028/4950]

x vTITEL push_back ( "PAWC_GW28Sep2005"  )

◆ push_back() [3029/4950]

x species_pp push_back ( "C_GW"  )

◆ push_back() [3030/4950]

x species_pp_version push_back ( "C_GW:PAW_LDA:28Sep2005"  )

◆ push_back() [3031/4950]

x species_pp_AUID push_back ( "b0690c638b8aa339"  )

◆ push_back() [3032/4950]

x species_pp_groundstate_structure push_back ( "N/A_b0690c638b8aa339"  )

◆ push_back() [3033/4950]

x vTITEL push_back ( "PAWC_h_GW23May2013"  )

◆ push_back() [3034/4950]

x species_pp push_back ( "C_h_GW"  )

◆ push_back() [3035/4950]

x species_pp_version push_back ( "C_h_GW:PAW_LDA:23May2013"  )

◆ push_back() [3036/4950]

x species_pp_AUID push_back ( "f1383956f2884cc2"  )

◆ push_back() [3037/4950]

x species_pp_groundstate_structure push_back ( "N/A_f1383956f2884cc2"  )

◆ push_back() [3038/4950]

x vTITEL push_back ( "PAWC_h06Feb2004"  )

◆ push_back() [3039/4950]

x species_pp_version push_back ( "C_h:PAW_LDA:06Feb2004"  )

◆ push_back() [3040/4950]

x species_pp_AUID push_back ( "06dc15fe38ec7bc7"  )

◆ push_back() [3041/4950]

x species_pp_groundstate_structure push_back ( "N/A_06dc15fe38ec7bc7"  )

◆ push_back() [3042/4950]

x vTITEL push_back ( "PAWCl_GW19Mar2012"  )

◆ push_back() [3043/4950]

x species_pp push_back ( "Cl_GW"  )

◆ push_back() [3044/4950]

x species_pp_version push_back ( "Cl_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [3045/4950]

x species_pp_AUID push_back ( "400cde0485f06908"  )

◆ push_back() [3046/4950]

x species_pp_groundstate_structure push_back ( "N/A_400cde0485f06908"  )

◆ push_back() [3047/4950]

x vTITEL push_back ( "PAWCl_h15Mar2012"  )

◆ push_back() [3048/4950]

x species_pp_version push_back ( "Cl_h:PAW_LDA:15Mar2012"  )

◆ push_back() [3049/4950]

x species_pp_AUID push_back ( "9942e79e2f8fc6a0"  )

◆ push_back() [3050/4950]

x species_pp_groundstate_structure push_back ( "N/A_9942e79e2f8fc6a0"  )

◆ push_back() [3051/4950]

x vTITEL push_back ( "PAWCl26Mar2009"  )

◆ push_back() [3052/4950]

x species_pp_version push_back ( "Cl:PAW_LDA:26Mar2009"  )

◆ push_back() [3053/4950]

x species_pp_AUID push_back ( "d7a144799213343f"  )

◆ push_back() [3054/4950]

x species_pp_groundstate_structure push_back ( "N/A_d7a144799213343f"  )

◆ push_back() [3055/4950]

x vTITEL push_back ( "PAWCm17Jan2011"  )

◆ push_back() [3056/4950]

x species_pp push_back ( "Cm"  )

◆ push_back() [3057/4950]

x species_Z push_back ( 96  )

◆ push_back() [3058/4950]

x species_pp_version push_back ( "Cm:PAW_LDA:17Jan2011"  )

◆ push_back() [3059/4950]

x species_pp_AUID push_back ( "b896b54b36e5a4e6"  )

◆ push_back() [3060/4950]

x species_pp_groundstate_structure push_back ( "N/A_b896b54b36e5a4e6"  )

◆ push_back() [3061/4950]

x vEATOM push_back ( 2632.  3538)

◆ push_back() [3062/4950]

x vTITEL push_back ( "PAWCo_GW31Mar2010"  )

◆ push_back() [3063/4950]

x species_pp push_back ( "Co_GW"  )

◆ push_back() [3064/4950]

x species_pp_version push_back ( "Co_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [3065/4950]

x species_pp_AUID push_back ( "55caba6c967c2367"  )

◆ push_back() [3066/4950]

x vTITEL push_back ( "PAWCo26Mar2009"  )

◆ push_back() [3067/4950]

x species_pp_version push_back ( "Co:PAW_LDA:26Mar2009"  )

◆ push_back() [3068/4950]

x species_pp_AUID push_back ( "6637b9e694868663"  )

◆ push_back() [3069/4950]

x vTITEL push_back ( "PAWCo_pv15Mar2012"  )

◆ push_back() [3070/4950]

x species_pp push_back ( "Co_pv"  )

◆ push_back() [3071/4950]

x species_pp_version push_back ( "Co_pv:PAW_LDA:15Mar2012"  )

◆ push_back() [3072/4950]

x species_pp_AUID push_back ( "9273ad55118191e1"  )

◆ push_back() [3073/4950]

x vEATOM push_back ( 2951.  4964)

◆ push_back() [3074/4950]

x vTITEL push_back ( "PAWCo_sv_GW05Dec2013"  )

◆ push_back() [3075/4950]

x species_pp push_back ( "Co_sv_GW"  )

◆ push_back() [3076/4950]

x species_pp_version push_back ( "Co_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3077/4950]

x species_pp_AUID push_back ( "552096566047fff9"  )

◆ push_back() [3078/4950]

x vEATOM push_back ( 3976.  5392)

◆ push_back() [3079/4950]

x vTITEL push_back ( "PAWCo_sv23Jul2007"  )

◆ push_back() [3080/4950]

x species_pp push_back ( "Co_sv"  )

◆ push_back() [3081/4950]

x species_pp_version push_back ( "Co_sv:PAW_LDA:23Jul2007"  )

◆ push_back() [3082/4950]

x species_pp_AUID push_back ( "ac83e5a2e9a83028"  )

◆ push_back() [3083/4950]

x vEATOM push_back ( 3977.  6284)

◆ push_back() [3084/4950]

x vTITEL push_back ( "PAWC22Mar2012"  )

◆ push_back() [3085/4950]

x species_pp_version push_back ( "C:PAW_LDA:22Mar2012"  )

◆ push_back() [3086/4950]

x species_pp_AUID push_back ( "0ffa932ee30b0a1c"  )

◆ push_back() [3087/4950]

x species_pp_groundstate_structure push_back ( "N/A_0ffa932ee30b0a1c"  )

◆ push_back() [3088/4950]

x species_pp_AUID push_back ( "86c325658e1c2bb2"  )

◆ push_back() [3089/4950]

x vTITEL push_back ( "PAWCr_pv02Aug2007"  )

◆ push_back() [3090/4950]

x species_pp_version push_back ( "Cr_pv:PAW_LDA:02Aug2007"  )

◆ push_back() [3091/4950]

x species_pp_AUID push_back ( "f5a28ee5ce72c4f2"  )

◆ push_back() [3092/4950]

x vTITEL push_back ( "PAWCr_sv_GW05Dec2013"  )

◆ push_back() [3093/4950]

x species_pp push_back ( "Cr_sv_GW"  )

◆ push_back() [3094/4950]

x species_pp_version push_back ( "Cr_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3095/4950]

x species_pp_AUID push_back ( "81df1668e8d9304c"  )

◆ push_back() [3096/4950]

x vEATOM push_back ( 2368.  3786)

◆ push_back() [3097/4950]

x vTITEL push_back ( "PAWCr_sv23Jul2007"  )

◆ push_back() [3098/4950]

x species_pp push_back ( "Cr_sv"  )

◆ push_back() [3099/4950]

x species_pp_version push_back ( "Cr_sv:PAW_LDA:23Jul2007"  )

◆ push_back() [3100/4950]

x species_pp_AUID push_back ( "79d9b9059234f4d3"  )

◆ push_back() [3101/4950]

x vEATOM push_back ( 2370.  1225)

◆ push_back() [3102/4950]

x species_pp_AUID push_back ( "c75973a7aa383f02"  )

◆ push_back() [3103/4950]

x species_pp_groundstate_structure push_back ( "N/A_c75973a7aa383f02"  )

◆ push_back() [3104/4950]

x vTITEL push_back ( "PAWCs_sv_GW23Mar2010"  )

◆ push_back() [3105/4950]

x species_pp push_back ( "Cs_sv_GW"  )

◆ push_back() [3106/4950]

x species_pp_version push_back ( "Cs_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3107/4950]

x species_pp_AUID push_back ( "42d5fdd268b1a941"  )

◆ push_back() [3108/4950]

x species_pp_AUID push_back ( "a7b37bbd60c921b0"  )

◆ push_back() [3109/4950]

x vTITEL push_back ( "PAWCu_GW19May2006"  )

◆ push_back() [3110/4950]

x species_pp push_back ( "Cu_GW"  )

◆ push_back() [3111/4950]

x species_pp_version push_back ( "Cu_GW:PAW_LDA:19May2006"  )

◆ push_back() [3112/4950]

x species_pp_AUID push_back ( "d15bb62d47c7b9be"  )

◆ push_back() [3113/4950]

x vTITEL push_back ( "PAWCu22Jun2005"  )

◆ push_back() [3114/4950]

x species_pp_version push_back ( "Cu:PAW_LDA:22Jun2005"  )

◆ push_back() [3115/4950]

x species_pp_AUID push_back ( "611c1c4066ac8e2c"  )

◆ push_back() [3116/4950]

x species_pp_AUID push_back ( "aed87d6c59ccf64b"  )

◆ push_back() [3117/4950]

x vEATOM push_back ( 4123.  9731)

◆ push_back() [3118/4950]

x vTITEL push_back ( "PAWCu_sv_GW05Dec2013"  )

◆ push_back() [3119/4950]

x species_pp push_back ( "Cu_sv_GW"  )

◆ push_back() [3120/4950]

x species_pp_version push_back ( "Cu_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3121/4950]

x species_pp_AUID push_back ( "9180a6efde161dbb"  )

◆ push_back() [3122/4950]

x vEATOM push_back ( 5383.  5414)

◆ push_back() [3123/4950]

x vTITEL push_back ( "PAWFe_GW31Mar2010"  )

◆ push_back() [3124/4950]

x species_pp push_back ( "Fe_GW"  )

◆ push_back() [3125/4950]

x species_pp_version push_back ( "Fe_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [3126/4950]

x species_pp_AUID push_back ( "d702aa64f30158e8"  )

◆ push_back() [3127/4950]

x species_pp_AUID push_back ( "1dc7f4fd5097d6bd"  )

◆ push_back() [3128/4950]

x vTITEL push_back ( "PAWFe_pv02Aug2007"  )

◆ push_back() [3129/4950]

x species_pp_version push_back ( "Fe_pv:PAW_LDA:02Aug2007"  )

◆ push_back() [3130/4950]

x species_pp_AUID push_back ( "5053a33b2b8de4ce"  )

◆ push_back() [3131/4950]

x vTITEL push_back ( "PAWFe_sv_GW05Dec2013"  )

◆ push_back() [3132/4950]

x species_pp push_back ( "Fe_sv_GW"  )

◆ push_back() [3133/4950]

x species_pp_version push_back ( "Fe_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3134/4950]

x species_pp_AUID push_back ( "e46d2489183a0133"  )

◆ push_back() [3135/4950]

x vEATOM push_back ( 3377.  3928)

◆ push_back() [3136/4950]

x vTITEL push_back ( "PAWFe_sv23Jul2007"  )

◆ push_back() [3137/4950]

x species_pp_version push_back ( "Fe_sv:PAW_LDA:23Jul2007"  )

◆ push_back() [3138/4950]

x species_pp_AUID push_back ( "b6b806587202e51a"  )

◆ push_back() [3139/4950]

x vEATOM push_back ( 3378.  6905)

◆ push_back() [3140/4950]

x vTITEL push_back ( "PAWF_GW19Mar2012"  )

◆ push_back() [3141/4950]

x species_pp push_back ( "F_GW"  )

◆ push_back() [3142/4950]

x species_pp_version push_back ( "F_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [3143/4950]

x species_pp_AUID push_back ( "24c86c8552b37685"  )

◆ push_back() [3144/4950]

x species_pp_groundstate_structure push_back ( "N/A_24c86c8552b37685"  )

◆ push_back() [3145/4950]

x vTITEL push_back ( "PAWF_GW21Dec2007"  )

◆ push_back() [3146/4950]

x species_pp_version push_back ( "F_GW:PAW_LDA:21Dec2007"  )

◆ push_back() [3147/4950]

x species_pp_AUID push_back ( "d9ea759608e1e9dd"  )

◆ push_back() [3148/4950]

x species_pp_groundstate_structure push_back ( "N/A_d9ea759608e1e9dd"  )

◆ push_back() [3149/4950]

x vTITEL push_back ( "PAWF_h_GW20May2014"  )

◆ push_back() [3150/4950]

x species_pp push_back ( "F_h_GW"  )

◆ push_back() [3151/4950]

x species_pp_version push_back ( "F_h_GW:PAW_LDA:20May2014"  )

◆ push_back() [3152/4950]

x species_pp_AUID push_back ( "5df81fde8f34a550"  )

◆ push_back() [3153/4950]

x species_pp_groundstate_structure push_back ( "N/A_5df81fde8f34a550"  )

◆ push_back() [3154/4950]

x vTITEL push_back ( "PAWF_h31May2013"  )

◆ push_back() [3155/4950]

x species_pp_version push_back ( "F_h:PAW_LDA:31May2013"  )

◆ push_back() [3156/4950]

x species_pp_AUID push_back ( "bea95ffbb0aa3b19"  )

◆ push_back() [3157/4950]

x species_pp_groundstate_structure push_back ( "N/A_bea95ffbb0aa3b19"  )

◆ push_back() [3158/4950]

x species_pp_AUID push_back ( "59dd5e10aeb44d25"  )

◆ push_back() [3159/4950]

x species_pp_groundstate_structure push_back ( "N/A_59dd5e10aeb44d25"  )

◆ push_back() [3160/4950]

x vTITEL push_back ( "PAWFr_sv29May2007"  )

◆ push_back() [3161/4950]

x species push_back ( "Fr"  )

◆ push_back() [3162/4950]

x species_Z push_back ( 87  )

◆ push_back() [3163/4950]

x species_pp push_back ( "Fr_sv"  )

◆ push_back() [3164/4950]

x species_pp_version push_back ( "Fr_sv:PAW_LDA:29May2007"  )

◆ push_back() [3165/4950]

x species_pp_AUID push_back ( "dcab31b5d6a71ec2"  )

◆ push_back() [3166/4950]

x species_pp_groundstate_structure push_back ( "N/A_dcab31b5d6a71ec2"  )

◆ push_back() [3167/4950]

x vEATOM push_back ( 532.  8109)

◆ push_back() [3168/4950]

x species_pp_AUID push_back ( "368cbc64ebdb1b2a"  )

◆ push_back() [3169/4950]

x species_pp_groundstate_structure push_back ( "N/A_368cbc64ebdb1b2a"  )

◆ push_back() [3170/4950]

x vTITEL push_back ( "PAWGa_d_GW15Mar2013"  )

◆ push_back() [3171/4950]

x species_pp push_back ( "Ga_d_GW"  )

◆ push_back() [3172/4950]

x species_pp_version push_back ( "Ga_d_GW:PAW_LDA:15Mar2013"  )

◆ push_back() [3173/4950]

x species_pp_AUID push_back ( "de616281415440db"  )

◆ push_back() [3174/4950]

x species_pp_groundstate_structure push_back ( "N/A_de616281415440db"  )

◆ push_back() [3175/4950]

x vTITEL push_back ( "PAWGa_d06Jul2010"  )

◆ push_back() [3176/4950]

x species_pp_version push_back ( "Ga_d:PAW_LDA:06Jul2010"  )

◆ push_back() [3177/4950]

x species_pp_AUID push_back ( "5430a8e736836812"  )

◆ push_back() [3178/4950]

x species_pp_groundstate_structure push_back ( "N/A_5430a8e736836812"  )

◆ push_back() [3179/4950]

x vTITEL push_back ( "PAWGa_GW22Mar2012"  )

◆ push_back() [3180/4950]

x species_pp push_back ( "Ga_GW"  )

◆ push_back() [3181/4950]

x species_pp_version push_back ( "Ga_GW:PAW_LDA:22Mar2012"  )

◆ push_back() [3182/4950]

x species_pp_AUID push_back ( "1214aa0702c868d2"  )

◆ push_back() [3183/4950]

x species_pp_groundstate_structure push_back ( "N/A_1214aa0702c868d2"  )

◆ push_back() [3184/4950]

x species_pp_AUID push_back ( "353191ce5059912a"  )

◆ push_back() [3185/4950]

x species_pp_groundstate_structure push_back ( "N/A_353191ce5059912a"  )

◆ push_back() [3186/4950]

x species_pp_AUID push_back ( "535f636b1375e8c7"  )

◆ push_back() [3187/4950]

x species_pp_groundstate_structure push_back ( "N/A_535f636b1375e8c7"  )

◆ push_back() [3188/4950]

x vTITEL push_back ( "PAWGa_sv_GW05Dec2013"  )

◆ push_back() [3189/4950]

x species_pp push_back ( "Ga_sv_GW"  )

◆ push_back() [3190/4950]

x species_pp_version push_back ( "Ga_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3191/4950]

x species_pp_AUID push_back ( "00db3a7073d0c29b"  )

◆ push_back() [3192/4950]

x species_pp_groundstate_structure push_back ( "N/A_00db3a7073d0c29b"  )

◆ push_back() [3193/4950]

x vEATOM push_back ( 7075.  9161)

◆ push_back() [3194/4950]

x vTITEL push_back ( "PAWGe_d_GW19Mar2013"  )

◆ push_back() [3195/4950]

x species_pp push_back ( "Ge_d_GW"  )

◆ push_back() [3196/4950]

x species_pp_version push_back ( "Ge_d_GW:PAW_LDA:19Mar2013"  )

◆ push_back() [3197/4950]

x species_pp_AUID push_back ( "b1f2f997b95fbbef"  )

◆ push_back() [3198/4950]

x species_pp_groundstate_structure push_back ( "N/A_b1f2f997b95fbbef"  )

◆ push_back() [3199/4950]

x vTITEL push_back ( "PAWGe_d03Jul2007"  )

◆ push_back() [3200/4950]

x species_pp_version push_back ( "Ge_d:PAW_LDA:03Jul2007"  )

◆ push_back() [3201/4950]

x species_pp_AUID push_back ( "ac64d7a50b752f2f"  )

◆ push_back() [3202/4950]

x species_pp_groundstate_structure push_back ( "N/A_ac64d7a50b752f2f"  )

◆ push_back() [3203/4950]

x vTITEL push_back ( "PAWGe04Okt2005"  )

◆ push_back() [3204/4950]

x species_pp_version push_back ( "Ge:PAW_LDA:04Okt2005"  )

◆ push_back() [3205/4950]

x species_pp_AUID push_back ( "18def5dc172f1231"  )

◆ push_back() [3206/4950]

x species_pp_groundstate_structure push_back ( "N/A_18def5dc172f1231"  )

◆ push_back() [3207/4950]

x species_pp_AUID push_back ( "b88cb8266ce47cf8"  )

◆ push_back() [3208/4950]

x species_pp_groundstate_structure push_back ( "N/A_b88cb8266ce47cf8"  )

◆ push_back() [3209/4950]

x species_pp_AUID push_back ( "a02ec8e584e9cdb3"  )

◆ push_back() [3210/4950]

x species_pp_groundstate_structure push_back ( "N/A_a02ec8e584e9cdb3"  )

◆ push_back() [3211/4950]

x vTITEL push_back ( "PAWGe_sv_GW26Apr2015"  )

◆ push_back() [3212/4950]

x species_pp push_back ( "Ge_sv_GW"  )

◆ push_back() [3213/4950]

x species_pp_version push_back ( "Ge_sv_GW:PAW_LDA:26Apr2015"  )

◆ push_back() [3214/4950]

x species_pp_AUID push_back ( "0975c1ee99d1c19b"  )

◆ push_back() [3215/4950]

x species_pp_groundstate_structure push_back ( "N/A_0975c1ee99d1c19b"  )

◆ push_back() [3216/4950]

x vEATOM push_back ( 8030.  1107)

◆ push_back() [3217/4950]

x species_pp_AUID push_back ( "113e55ae02a8166b"  )

◆ push_back() [3218/4950]

x species_pp_groundstate_structure push_back ( "N/A_113e55ae02a8166b"  )

◆ push_back() [3219/4950]

x vTITEL push_back ( "PAWH1.3306Jun2006"  )

◆ push_back() [3220/4950]

x species_pp push_back ( "H1.33"  )

◆ push_back() [3221/4950]

x species_pp_version push_back ( "H1.33:PAW_LDA:06Jun2006"  )

◆ push_back() [3222/4950]

x species_pp_AUID push_back ( "d3d4ddf28d8e1349"  )

◆ push_back() [3223/4950]

x species_pp_groundstate_structure push_back ( "N/A_d3d4ddf28d8e1349"  )

◆ push_back() [3224/4950]

x vEATOM push_back ( 25.  6396)

◆ push_back() [3225/4950]

x species_pp_AUID push_back ( "7bc9c02e28342182"  )

◆ push_back() [3226/4950]

x species_pp_groundstate_structure push_back ( "N/A_7bc9c02e28342182"  )

◆ push_back() [3227/4950]

x vTITEL push_back ( "PAWH1.6622Sep2006"  )

◆ push_back() [3228/4950]

x species_pp push_back ( "H1.66"  )

◆ push_back() [3229/4950]

x species_pp_version push_back ( "H1.66:PAW_LDA:22Sep2006"  )

◆ push_back() [3230/4950]

x species_pp_AUID push_back ( "019af9f113ceb7e1"  )

◆ push_back() [3231/4950]

x species_pp_groundstate_structure push_back ( "N/A_019af9f113ceb7e1"  )

◆ push_back() [3232/4950]

x vEATOM push_back ( 46.  4452)

◆ push_back() [3233/4950]

x vTITEL push_back ( "PAWH1.7505Aug2008"  )

◆ push_back() [3234/4950]

x species_pp push_back ( "H1.75"  )

◆ push_back() [3235/4950]

x species_pp_version push_back ( "H1.75:PAW_LDA:05Aug2008"  )

◆ push_back() [3236/4950]

x species_pp_AUID push_back ( "06f923b60979eded"  )

◆ push_back() [3237/4950]

x species_pp_groundstate_structure push_back ( "N/A_06f923b60979eded"  )

◆ push_back() [3238/4950]

x vTITEL push_back ( "PAWH.2505Aug2008"  )

◆ push_back() [3239/4950]

x species_pp push_back ( "H.25"  )

◆ push_back() [3240/4950]

x species_pp_version push_back ( "H.25:PAW_LDA:05Aug2008"  )

◆ push_back() [3241/4950]

x species_pp_AUID push_back ( "eefef035fd6ecf48"  )

◆ push_back() [3242/4950]

x species_pp_groundstate_structure push_back ( "N/A_eefef035fd6ecf48"  )

◆ push_back() [3243/4950]

x vTITEL push_back ( "PAWH.3322Sep2006"  )

◆ push_back() [3244/4950]

x species_pp push_back ( "H.33"  )

◆ push_back() [3245/4950]

x species_pp_version push_back ( "H.33:PAW_LDA:22Sep2006"  )

◆ push_back() [3246/4950]

x species_pp_AUID push_back ( "3b8ae430d87c0e50"  )

◆ push_back() [3247/4950]

x species_pp_groundstate_structure push_back ( "N/A_3b8ae430d87c0e50"  )

◆ push_back() [3248/4950]

x vTITEL push_back ( "PAWH.4219Jan2011"  )

◆ push_back() [3249/4950]

x species_pp push_back ( "H.42"  )

◆ push_back() [3250/4950]

x species_pp_version push_back ( "H.42:PAW_LDA:19Jan2011"  )

◆ push_back() [3251/4950]

x species_pp_AUID push_back ( "8998e705acf0e3ab"  )

◆ push_back() [3252/4950]

x species_pp_groundstate_structure push_back ( "N/A_8998e705acf0e3ab"  )

◆ push_back() [3253/4950]

x vTITEL push_back ( "PAWH.5819Jan2011"  )

◆ push_back() [3254/4950]

x species_pp push_back ( "H.58"  )

◆ push_back() [3255/4950]

x species_pp_version push_back ( "H.58:PAW_LDA:19Jan2011"  )

◆ push_back() [3256/4950]

x species_pp_AUID push_back ( "964a0be8b3f293f5"  )

◆ push_back() [3257/4950]

x species_pp_groundstate_structure push_back ( "N/A_964a0be8b3f293f5"  )

◆ push_back() [3258/4950]

x species_pp_AUID push_back ( "41ef48c549d944e9"  )

◆ push_back() [3259/4950]

x species_pp_groundstate_structure push_back ( "N/A_41ef48c549d944e9"  )

◆ push_back() [3260/4950]

x vTITEL push_back ( "PAWH.6606Jun2006"  )

◆ push_back() [3261/4950]

x species_pp push_back ( "H.66"  )

◆ push_back() [3262/4950]

x species_pp_version push_back ( "H.66:PAW_LDA:06Jun2006"  )

◆ push_back() [3263/4950]

x species_pp_AUID push_back ( "22bb9a5b0821e32c"  )

◆ push_back() [3264/4950]

x species_pp_groundstate_structure push_back ( "N/A_22bb9a5b0821e32c"  )

◆ push_back() [3265/4950]

x species_pp_AUID push_back ( "bce3408dd20e75be"  )

◆ push_back() [3266/4950]

x species_pp_groundstate_structure push_back ( "N/A_bce3408dd20e75be"  )

◆ push_back() [3267/4950]

x species_pp_type push_back ( "AE"  )

◆ push_back() [3268/4950]

x species_pp_version push_back ( "H:AE:BigBang"  )

◆ push_back() [3269/4950]

x species_pp_AUID push_back ( "edf38269016fb988"  )

◆ push_back() [3270/4950]

x species_pp_groundstate_structure push_back ( "N/A_edf38269016fb988"  )

◆ push_back() [3271/4950]

x vTITEL push_back ( "PAWHe_GW13May2007"  )

◆ push_back() [3272/4950]

x species_pp push_back ( "He_GW"  )

◆ push_back() [3273/4950]

x species_pp_version push_back ( "He_GW:PAW_LDA:13May2007"  )

◆ push_back() [3274/4950]

x species_pp_AUID push_back ( "01384ea060f2fc4f"  )

◆ push_back() [3275/4950]

x species_pp_groundstate_structure push_back ( "N/A_01384ea060f2fc4f"  )

◆ push_back() [3276/4950]

x species_pp_AUID push_back ( "64a378e22697e477"  )

◆ push_back() [3277/4950]

x species_pp_groundstate_structure push_back ( "N/A_64a378e22697e477"  )

◆ push_back() [3278/4950]

x species_pp_AUID push_back ( "9f5b6eb8e91b7bb6"  )

◆ push_back() [3279/4950]

x species_pp_AUID push_back ( "117e9d5b1780b640"  )

◆ push_back() [3280/4950]

x vTITEL push_back ( "PAWHf_sv_GW16Jan2015"  )

◆ push_back() [3281/4950]

x species_pp push_back ( "Hf_sv_GW"  )

◆ push_back() [3282/4950]

x species_pp_version push_back ( "Hf_sv_GW:PAW_LDA:16Jan2015"  )

◆ push_back() [3283/4950]

x species_pp_AUID push_back ( "a43077ac3bc180ef"  )

◆ push_back() [3284/4950]

x vEATOM push_back ( 1352.  9922)

◆ push_back() [3285/4950]

x vTITEL push_back ( "PAWHf_sv10Jan2008GWsuitable"  )

◆ push_back() [3286/4950]

x species_pp push_back ( "Hf_sv"  )

◆ push_back() [3287/4950]

x species_pp_version push_back ( "Hf_sv:PAW_LDA:10Jan2008"  )

◆ push_back() [3288/4950]

x species_pp_AUID push_back ( "741e770dc2182cae"  )

◆ push_back() [3289/4950]

x species_pp_groundstate_structure push_back ( "N/A_741e770dc2182cae"  )

◆ push_back() [3290/4950]

x species_pp_AUID push_back ( "975520ff1e493a93"  )

◆ push_back() [3291/4950]

x species_pp_groundstate_structure push_back ( "N/A_975520ff1e493a93"  )

◆ push_back() [3292/4950]

x vTITEL push_back ( "PAWHg_sv_GW16Apr2014"  )

◆ push_back() [3293/4950]

x species_pp push_back ( "Hg_sv_GW"  )

◆ push_back() [3294/4950]

x species_pp_version push_back ( "Hg_sv_GW:PAW_LDA:16Apr2014"  )

◆ push_back() [3295/4950]

x species_pp_AUID push_back ( "5d7c62d2ffcb80e6"  )

◆ push_back() [3296/4950]

x species_pp_groundstate_structure push_back ( "N/A_5d7c62d2ffcb80e6"  )

◆ push_back() [3297/4950]

x vEATOM push_back ( 4237.  4019)

◆ push_back() [3298/4950]

x vTITEL push_back ( "PAWH_GW21Apr2008"  )

◆ push_back() [3299/4950]

x species_pp push_back ( "H_GW"  )

◆ push_back() [3300/4950]

x species_pp_version push_back ( "H_GW:PAW_LDA:21Apr2008"  )

◆ push_back() [3301/4950]

x species_pp_AUID push_back ( "09b947bdc06ee37f"  )

◆ push_back() [3302/4950]

x species_pp_groundstate_structure push_back ( "N/A_09b947bdc06ee37f"  )

◆ push_back() [3303/4950]

x vTITEL push_back ( "PAWH_h_GW21Apr2008"  )

◆ push_back() [3304/4950]

x species_pp push_back ( "H_h_GW"  )

◆ push_back() [3305/4950]

x species_pp_version push_back ( "H_h_GW:PAW_LDA:21Apr2008"  )

◆ push_back() [3306/4950]

x species_pp_AUID push_back ( "47a8fe689ffeb5c3"  )

◆ push_back() [3307/4950]

x species_pp_groundstate_structure push_back ( "N/A_47a8fe689ffeb5c3"  )

◆ push_back() [3308/4950]

x species_pp_AUID push_back ( "57d1d39ae4463ef2"  )

◆ push_back() [3309/4950]

x species_pp_groundstate_structure push_back ( "N/A_57d1d39ae4463ef2"  )

◆ push_back() [3310/4950]

x species_pp_AUID push_back ( "ffd96425fe2cfd9a"  )

◆ push_back() [3311/4950]

x species_pp_groundstate_structure push_back ( "N/A_ffd96425fe2cfd9a"  )

◆ push_back() [3312/4950]

x vTITEL push_back ( "PAWH_s15May2010"  )

◆ push_back() [3313/4950]

x species_pp push_back ( "H_s"  )

◆ push_back() [3314/4950]

x species_pp_version push_back ( "H_s:PAW_LDA:15May2010"  )

◆ push_back() [3315/4950]

x species_pp_AUID push_back ( "38238baed3364a4e"  )

◆ push_back() [3316/4950]

x species_pp_groundstate_structure push_back ( "N/A_38238baed3364a4e"  )

◆ push_back() [3317/4950]

x vTITEL push_back ( "PAWI_GW12Mar2012"  )

◆ push_back() [3318/4950]

x species_pp push_back ( "I_GW"  )

◆ push_back() [3319/4950]

x species_pp_version push_back ( "I_GW:PAW_LDA:12Mar2012"  )

◆ push_back() [3320/4950]

x species_pp_AUID push_back ( "3aee4073de690a04"  )

◆ push_back() [3321/4950]

x species_pp_groundstate_structure push_back ( "N/A_3aee4073de690a04"  )

◆ push_back() [3322/4950]

x vTITEL push_back ( "PAWIn_d_GW15Mar2013"  )

◆ push_back() [3323/4950]

x species_pp push_back ( "In_d_GW"  )

◆ push_back() [3324/4950]

x species_pp_version push_back ( "In_d_GW:PAW_LDA:15Mar2013"  )

◆ push_back() [3325/4950]

x species_pp_AUID push_back ( "22732bd56194fc28"  )

◆ push_back() [3326/4950]

x species_pp_groundstate_structure push_back ( "N/A_22732bd56194fc28"  )

◆ push_back() [3327/4950]

x species_pp_AUID push_back ( "2254fab53f7eda6c"  )

◆ push_back() [3328/4950]

x species_pp_groundstate_structure push_back ( "N/A_2254fab53f7eda6c"  )

◆ push_back() [3329/4950]

x species_pp_AUID push_back ( "f42e1ff46811bb75"  )

◆ push_back() [3330/4950]

x species_pp_groundstate_structure push_back ( "N/A_f42e1ff46811bb75"  )

◆ push_back() [3331/4950]

x vTITEL push_back ( "PAWIn_sv_GW22Nov2013"  )

◆ push_back() [3332/4950]

x species_pp push_back ( "In_sv_GW"  )

◆ push_back() [3333/4950]

x species_pp_version push_back ( "In_sv_GW:PAW_LDA:22Nov2013"  )

◆ push_back() [3334/4950]

x species_pp_AUID push_back ( "1da34918c80b3342"  )

◆ push_back() [3335/4950]

x species_pp_groundstate_structure push_back ( "N/A_1da34918c80b3342"  )

◆ push_back() [3336/4950]

x vEATOM push_back ( 5207.  0668)

◆ push_back() [3337/4950]

x species_pp_AUID push_back ( "78ad23c676b989bb"  )

◆ push_back() [3338/4950]

x species_pp_groundstate_structure push_back ( "N/A_78ad23c676b989bb"  )

◆ push_back() [3339/4950]

x species_pp_AUID push_back ( "f143f80475599f27"  )

◆ push_back() [3340/4950]

x vTITEL push_back ( "PAWIr_sv_GW23Mar2010"  )

◆ push_back() [3341/4950]

x species_pp push_back ( "Ir_sv_GW"  )

◆ push_back() [3342/4950]

x species_pp_version push_back ( "Ir_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3343/4950]

x species_pp_AUID push_back ( "c40fbe0470edb1a3"  )

◆ push_back() [3344/4950]

x vEATOM push_back ( 2888.  7257)

◆ push_back() [3345/4950]

x vTITEL push_back ( "PAWI_sv_GW22Nov2013"  )

◆ push_back() [3346/4950]

x species_pp push_back ( "I_sv_GW"  )

◆ push_back() [3347/4950]

x species_pp_version push_back ( "I_sv_GW:PAW_LDA:22Nov2013"  )

◆ push_back() [3348/4950]

x species_pp_AUID push_back ( "a43917ccfaca85c9"  )

◆ push_back() [3349/4950]

x species_pp_groundstate_structure push_back ( "N/A_a43917ccfaca85c9"  )

◆ push_back() [3350/4950]

x vEATOM push_back ( 8145.  1977)

◆ push_back() [3351/4950]

x vTITEL push_back ( "PAWK_pv22Nov2003"  )

◆ push_back() [3352/4950]

x species_pp_version push_back ( "K_pv:PAW_LDA:22Nov2003"  )

◆ push_back() [3353/4950]

x species_pp_AUID push_back ( "cd771e7ca0b75f0c"  )

◆ push_back() [3354/4950]

x vTITEL push_back ( "PAWKr_GW21Aug2013"  )

◆ push_back() [3355/4950]

x species_pp push_back ( "Kr_GW"  )

◆ push_back() [3356/4950]

x species_pp_version push_back ( "Kr_GW:PAW_LDA:21Aug2013"  )

◆ push_back() [3357/4950]

x species_pp_AUID push_back ( "6c88dd7f574b0dd1"  )

◆ push_back() [3358/4950]

x species_pp_groundstate_structure push_back ( "N/A_6c88dd7f574b0dd1"  )

◆ push_back() [3359/4950]

x species_pp_AUID push_back ( "e1295df589c1b598"  )

◆ push_back() [3360/4950]

x species_pp_groundstate_structure push_back ( "N/A_e1295df589c1b598"  )

◆ push_back() [3361/4950]

x vTITEL push_back ( "PAWK_sv_GW31Mar2010"  )

◆ push_back() [3362/4950]

x species_pp push_back ( "K_sv_GW"  )

◆ push_back() [3363/4950]

x species_pp_version push_back ( "K_sv_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [3364/4950]

x species_pp_AUID push_back ( "f21b701c5a994872"  )

◆ push_back() [3365/4950]

x vEATOM push_back ( 773.  0252)

◆ push_back() [3366/4950]

x vTITEL push_back ( "PAWK_sv22Nov2003"  )

◆ push_back() [3367/4950]

x species_pp_version push_back ( "K_sv:PAW_LDA:22Nov2003"  )

◆ push_back() [3368/4950]

x species_pp_AUID push_back ( "c231ba698148ee95"  )

◆ push_back() [3369/4950]

x vTITEL push_back ( "PAWLa_GW16May2012"  )

◆ push_back() [3370/4950]

x species_pp push_back ( "La_GW"  )

◆ push_back() [3371/4950]

x species_pp_version push_back ( "La_GW:PAW_LDA:16May2012"  )

◆ push_back() [3372/4950]

x species_pp_AUID push_back ( "47faddba936a625c"  )

◆ push_back() [3373/4950]

x vEATOM push_back ( 870.  1529)

◆ push_back() [3374/4950]

x species_pp_AUID push_back ( "1bafc710bd53cb57"  )

◆ push_back() [3375/4950]

x species_pp_AUID push_back ( "54eb962a4ef4ea32"  )

◆ push_back() [3376/4950]

x vTITEL push_back ( "PAWLi_AE_GW25Mar2010"  )

◆ push_back() [3377/4950]

x species_pp push_back ( "Li_AE_GW"  )

◆ push_back() [3378/4950]

x species_pp_version push_back ( "Li_AE_GW:PAW_LDA:25Mar2010"  )

◆ push_back() [3379/4950]

x species_pp_AUID push_back ( "e3a6007a49bfc154"  )

◆ push_back() [3380/4950]

x vEATOM push_back ( 197.  8207)

◆ push_back() [3381/4950]

x vTITEL push_back ( "PAWLi_GW11May2007"  )

◆ push_back() [3382/4950]

x species_pp push_back ( "Li_GW"  )

◆ push_back() [3383/4950]

x species_pp_version push_back ( "Li_GW:PAW_LDA:11May2007"  )

◆ push_back() [3384/4950]

x species_pp_AUID push_back ( "78d965ff372a7e11"  )

◆ push_back() [3385/4950]

x vTITEL push_back ( "PAWLi15Mar2012"  )

◆ push_back() [3386/4950]

x species_pp_version push_back ( "Li:PAW_LDA:15Mar2012"  )

◆ push_back() [3387/4950]

x species_pp_AUID push_back ( "faf632cf08a133d7"  )

◆ push_back() [3388/4950]

x vTITEL push_back ( "PAWLi_sv_GW25Mar2010"  )

◆ push_back() [3389/4950]

x species_pp push_back ( "Li_sv_GW"  )

◆ push_back() [3390/4950]

x species_pp_version push_back ( "Li_sv_GW:PAW_LDA:25Mar2010"  )

◆ push_back() [3391/4950]

x species_pp_AUID push_back ( "157d4a0ea0712143"  )

◆ push_back() [3392/4950]

x vTITEL push_back ( "PAWLi_sv10Sep2004"  )

◆ push_back() [3393/4950]

x species_pp_version push_back ( "Li_sv:PAW_LDA:10Sep2004"  )

◆ push_back() [3394/4950]

x species_pp_AUID push_back ( "2d76bbafaaad041b"  )

◆ push_back() [3395/4950]

x vTITEL push_back ( "PAWMg_GW13Apr2007"  )

◆ push_back() [3396/4950]

x species_pp push_back ( "Mg_GW"  )

◆ push_back() [3397/4950]

x species_pp_version push_back ( "Mg_GW:PAW_LDA:13Apr2007"  )

◆ push_back() [3398/4950]

x species_pp_AUID push_back ( "10cfb435085a0f1b"  )

◆ push_back() [3399/4950]

x vTITEL push_back ( "PAWMg13Apr2007"  )

◆ push_back() [3400/4950]

x species_pp_version push_back ( "Mg:PAW_LDA:13Apr2007"  )

◆ push_back() [3401/4950]

x species_pp_AUID push_back ( "590af3dee2a4fe48"  )

◆ push_back() [3402/4950]

x vTITEL push_back ( "PAWMg_pv_GW20Apr2010"  )

◆ push_back() [3403/4950]

x species_pp push_back ( "Mg_pv_GW"  )

◆ push_back() [3404/4950]

x species_pp_version push_back ( "Mg_pv_GW:PAW_LDA:20Apr2010"  )

◆ push_back() [3405/4950]

x species_pp_AUID push_back ( "069806e2f2e95d29"  )

◆ push_back() [3406/4950]

x vTITEL push_back ( "PAWMg_pv13Apr2007"  )

◆ push_back() [3407/4950]

x species_pp_version push_back ( "Mg_pv:PAW_LDA:13Apr2007"  )

◆ push_back() [3408/4950]

x species_pp_AUID push_back ( "013b0f18810c46a4"  )

◆ push_back() [3409/4950]

x vTITEL push_back ( "PAWMg_sv_GW20Apr2010"  )

◆ push_back() [3410/4950]

x species_pp push_back ( "Mg_sv_GW"  )

◆ push_back() [3411/4950]

x species_pp_version push_back ( "Mg_sv_GW:PAW_LDA:20Apr2010"  )

◆ push_back() [3412/4950]

x species_pp_AUID push_back ( "e17bc5af0b84ca63"  )

◆ push_back() [3413/4950]

x species_pp_groundstate_energy push_back ( -16.  05968)

◆ push_back() [3414/4950]

x vEATOM push_back ( 1711.  0785)

◆ push_back() [3415/4950]

x vTITEL push_back ( "PAWMg_sv15Mar2012"  )

◆ push_back() [3416/4950]

x species_pp push_back ( "Mg_sv"  )

◆ push_back() [3417/4950]

x species_pp_version push_back ( "Mg_sv:PAW_LDA:15Mar2012"  )

◆ push_back() [3418/4950]

x species_pp_AUID push_back ( "ece8e1f37bb686ef"  )

◆ push_back() [3419/4950]

x vEATOM push_back ( 1725.  3711)

◆ push_back() [3420/4950]

x vTITEL push_back ( "PAWMn_GW31Mar2010"  )

◆ push_back() [3421/4950]

x species_pp push_back ( "Mn_GW"  )

◆ push_back() [3422/4950]

x species_pp_version push_back ( "Mn_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [3423/4950]

x species_pp_AUID push_back ( "e5ef356c78e0abfe"  )

◆ push_back() [3424/4950]

x species_pp_groundstate_structure push_back ( "N/A_e5ef356c78e0abfe"  )

◆ push_back() [3425/4950]

x species_pp_AUID push_back ( "5e201c7686521915"  )

◆ push_back() [3426/4950]

x species_pp_groundstate_structure push_back ( "N/A_5e201c7686521915"  )

◆ push_back() [3427/4950]

x vTITEL push_back ( "PAWMn_pv02Aug2007"  )

◆ push_back() [3428/4950]

x species_pp_version push_back ( "Mn_pv:PAW_LDA:02Aug2007"  )

◆ push_back() [3429/4950]

x species_pp_AUID push_back ( "e989d4d6f24b0c0b"  )

◆ push_back() [3430/4950]

x species_pp_groundstate_structure push_back ( "N/A_e989d4d6f24b0c0b"  )

◆ push_back() [3431/4950]

x vTITEL push_back ( "PAWMn_sv_GW05Dec2013"  )

◆ push_back() [3432/4950]

x species_pp push_back ( "Mn_sv_GW"  )

◆ push_back() [3433/4950]

x species_pp_version push_back ( "Mn_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3434/4950]

x species_pp_AUID push_back ( "5bfe86d3b5c0e4f3"  )

◆ push_back() [3435/4950]

x species_pp_groundstate_structure push_back ( "N/A_5bfe86d3b5c0e4f3"  )

◆ push_back() [3436/4950]

x vEATOM push_back ( 2842.  5899)

◆ push_back() [3437/4950]

x vTITEL push_back ( "PAWMn_sv23Jul2007"  )

◆ push_back() [3438/4950]

x species_pp push_back ( "Mn_sv"  )

◆ push_back() [3439/4950]

x species_pp_version push_back ( "Mn_sv:PAW_LDA:23Jul2007"  )

◆ push_back() [3440/4950]

x species_pp_AUID push_back ( "86693bf35ed4986f"  )

◆ push_back() [3441/4950]

x species_pp_groundstate_structure push_back ( "N/A_86693bf35ed4986f"  )

◆ push_back() [3442/4950]

x vEATOM push_back ( 2844.  108)

◆ push_back() [3443/4950]

x vTITEL push_back ( "PAWMo08Apr2002"  )

◆ push_back() [3444/4950]

x species_pp_version push_back ( "Mo:PAW_LDA:08Apr2002"  )

◆ push_back() [3445/4950]

x species_pp_AUID push_back ( "25f5fda9fc8c9cff"  )

◆ push_back() [3446/4950]

x vTITEL push_back ( "PAWMo_pv04Feb2005"  )

◆ push_back() [3447/4950]

x species_pp_version push_back ( "Mo_pv:PAW_LDA:04Feb2005"  )

◆ push_back() [3448/4950]

x species_pp_AUID push_back ( "bd15acc21b11b902"  )

◆ push_back() [3449/4950]

x vTITEL push_back ( "PAWMo_sv_GW05Dec2013"  )

◆ push_back() [3450/4950]

x species_pp push_back ( "Mo_sv_GW"  )

◆ push_back() [3451/4950]

x species_pp_version push_back ( "Mo_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3452/4950]

x species_pp_AUID push_back ( "fc1f92a69942b43d"  )

◆ push_back() [3453/4950]

x vEATOM push_back ( 1864.  8244)

◆ push_back() [3454/4950]

x vTITEL push_back ( "PAWMo_sv29Jan2005"  )

◆ push_back() [3455/4950]

x species_pp_version push_back ( "Mo_sv:PAW_LDA:29Jan2005"  )

◆ push_back() [3456/4950]

x species_pp_AUID push_back ( "0f8c2e9ac364f9e3"  )

◆ push_back() [3457/4950]

x species_pp_AUID push_back ( "e720028a65d0fbc7"  )

◆ push_back() [3458/4950]

x vTITEL push_back ( "PAWNa_pv19Dec2003"  )

◆ push_back() [3459/4950]

x species_pp_version push_back ( "Na_pv:PAW_LDA:19Dec2003"  )

◆ push_back() [3460/4950]

x species_pp_AUID push_back ( "0e2d9945823de573"  )

◆ push_back() [3461/4950]

x vTITEL push_back ( "PAWNa_sv_GW11May2015"  )

◆ push_back() [3462/4950]

x species_pp push_back ( "Na_sv_GW"  )

◆ push_back() [3463/4950]

x species_pp_version push_back ( "Na_sv_GW:PAW_LDA:11May2015"  )

◆ push_back() [3464/4950]

x species_pp_AUID push_back ( "6e7e25a6de2a42c0"  )

◆ push_back() [3465/4950]

x vEATOM push_back ( 1303.  3627)

◆ push_back() [3466/4950]

x species_pp_AUID push_back ( "60a75938718c0f9d"  )

◆ push_back() [3467/4950]

x species_pp_AUID push_back ( "125b6a029adf24ea"  )

◆ push_back() [3468/4950]

x vTITEL push_back ( "PAWNb_sv_GW05Dec2013"  )

◆ push_back() [3469/4950]

x species_pp push_back ( "Nb_sv_GW"  )

◆ push_back() [3470/4950]

x species_pp_version push_back ( "Nb_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3471/4950]

x species_pp_AUID push_back ( "9b8caffbad647df6"  )

◆ push_back() [3472/4950]

x vEATOM push_back ( 1557.  071)

◆ push_back() [3473/4950]

x vTITEL push_back ( "PAWNb_sv25May2007"  )

◆ push_back() [3474/4950]

x species_pp_version push_back ( "Nb_sv:PAW_LDA:25May2007"  )

◆ push_back() [3475/4950]

x species_pp_AUID push_back ( "7b5ec33ec65ced5a"  )

◆ push_back() [3476/4950]

x vTITEL push_back ( "PAWNe_GW22Sep2014"  )

◆ push_back() [3477/4950]

x species_pp push_back ( "Ne_GW"  )

◆ push_back() [3478/4950]

x species_pp_version push_back ( "Ne_GW:PAW_LDA:22Sep2014"  )

◆ push_back() [3479/4950]

x species_pp_AUID push_back ( "3444109214f68eab"  )

◆ push_back() [3480/4950]

x species_pp_AUID push_back ( "1db85f57d622abef"  )

◆ push_back() [3481/4950]

x vTITEL push_back ( "PAWNe_s_GW02Oct2006"  )

◆ push_back() [3482/4950]

x species_pp push_back ( "Ne_s_GW"  )

◆ push_back() [3483/4950]

x species_pp_version push_back ( "Ne_s_GW:PAW_LDA:02Oct2006"  )

◆ push_back() [3484/4950]

x species_pp_AUID push_back ( "687e59556bdcdb00"  )

◆ push_back() [3485/4950]

x vTITEL push_back ( "PAWN_GW_new19Mar2012"  )

◆ push_back() [3486/4950]

x species_pp push_back ( "N_GW_new"  )

◆ push_back() [3487/4950]

x species_pp_version push_back ( "N_GW_new:PAW_LDA:19Mar2012"  )

◆ push_back() [3488/4950]

x species_pp_AUID push_back ( "33a6187d74d4879f"  )

◆ push_back() [3489/4950]

x species_pp_groundstate_structure push_back ( "N/A_33a6187d74d4879f"  )

◆ push_back() [3490/4950]

x vTITEL push_back ( "PAWN_GW10Apr2007"  )

◆ push_back() [3491/4950]

x species_pp push_back ( "N_GW"  )

◆ push_back() [3492/4950]

x species_pp_version push_back ( "N_GW:PAW_LDA:10Apr2007"  )

◆ push_back() [3493/4950]

x species_pp_AUID push_back ( "c128b64229839c6c"  )

◆ push_back() [3494/4950]

x species_pp_groundstate_structure push_back ( "N/A_c128b64229839c6c"  )

◆ push_back() [3495/4950]

x vTITEL push_back ( "PAWN_h_GW03Jul2013"  )

◆ push_back() [3496/4950]

x species_pp push_back ( "N_h_GW"  )

◆ push_back() [3497/4950]

x species_pp_version push_back ( "N_h_GW:PAW_LDA:03Jul2013"  )

◆ push_back() [3498/4950]

x species_pp_AUID push_back ( "e8c86240b25e3a96"  )

◆ push_back() [3499/4950]

x species_pp_groundstate_structure push_back ( "N/A_e8c86240b25e3a96"  )

◆ push_back() [3500/4950]

x vTITEL push_back ( "PAWN_h06Feb2004"  )

◆ push_back() [3501/4950]

x species_pp_version push_back ( "N_h:PAW_LDA:06Feb2004"  )

◆ push_back() [3502/4950]

x species_pp_AUID push_back ( "c8b1df1e114b265e"  )

◆ push_back() [3503/4950]

x species_pp_groundstate_structure push_back ( "N/A_c8b1df1e114b265e"  )

◆ push_back() [3504/4950]

x vTITEL push_back ( "PAWNi_GW31Mar2010"  )

◆ push_back() [3505/4950]

x species_pp push_back ( "Ni_GW"  )

◆ push_back() [3506/4950]

x species_pp_version push_back ( "Ni_GW:PAW_LDA:31Mar2010"  )

◆ push_back() [3507/4950]

x species_pp_AUID push_back ( "f57c7aee2773cf5c"  )

◆ push_back() [3508/4950]

x vTITEL push_back ( "PAWNi02Aug2007"  )

◆ push_back() [3509/4950]

x species_pp_version push_back ( "Ni:PAW_LDA:02Aug2007"  )

◆ push_back() [3510/4950]

x species_pp_AUID push_back ( "5fe58cf81946c37d"  )

◆ push_back() [3511/4950]

x species_pp_AUID push_back ( "3d3b495397078a92"  )

◆ push_back() [3512/4950]

x vTITEL push_back ( "PAWNi_sv_GW05Dec2013"  )

◆ push_back() [3513/4950]

x species_pp push_back ( "Ni_sv_GW"  )

◆ push_back() [3514/4950]

x species_pp_version push_back ( "Ni_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3515/4950]

x species_pp_AUID push_back ( "bf5d7aa5efb4320a"  )

◆ push_back() [3516/4950]

x vEATOM push_back ( 4643.  7763)

◆ push_back() [3517/4950]

x vTITEL push_back ( "PAWN21Mar2012"  )

◆ push_back() [3518/4950]

x species_pp_version push_back ( "N:PAW_LDA:21Mar2012"  )

◆ push_back() [3519/4950]

x species_pp_AUID push_back ( "90b9ad985bdc4f9d"  )

◆ push_back() [3520/4950]

x species_pp_groundstate_structure push_back ( "N/A_90b9ad985bdc4f9d"  )

◆ push_back() [3521/4950]

x species_pp_AUID push_back ( "210d5f8ccd5b53c6"  )

◆ push_back() [3522/4950]

x species_pp_groundstate_structure push_back ( "N/A_210d5f8ccd5b53c6"  )

◆ push_back() [3523/4950]

x species_pp_AUID push_back ( "1acbca274aaf441e"  )

◆ push_back() [3524/4950]

x species_pp_groundstate_structure push_back ( "N/A_1acbca274aaf441e"  )

◆ push_back() [3525/4950]

x vTITEL push_back ( "PAWN_s_GW04Apr2007"  )

◆ push_back() [3526/4950]

x species_pp push_back ( "N_s_GW"  )

◆ push_back() [3527/4950]

x species_pp_version push_back ( "N_s_GW:PAW_LDA:04Apr2007"  )

◆ push_back() [3528/4950]

x species_pp_AUID push_back ( "69284cbf1de6f7ec"  )

◆ push_back() [3529/4950]

x species_pp_groundstate_structure push_back ( "N/A_69284cbf1de6f7ec"  )

◆ push_back() [3530/4950]

x species_pp_AUID push_back ( "71444903544a9470"  )

◆ push_back() [3531/4950]

x species_pp_groundstate_structure push_back ( "N/A_71444903544a9470"  )

◆ push_back() [3532/4950]

x vTITEL push_back ( "PAWO_GW19Mar2012"  )

◆ push_back() [3533/4950]

x species_pp push_back ( "O_GW"  )

◆ push_back() [3534/4950]

x species_pp_version push_back ( "O_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [3535/4950]

x species_pp_AUID push_back ( "6ee872e1972ccc8f"  )

◆ push_back() [3536/4950]

x species_pp_groundstate_structure push_back ( "N/A_6ee872e1972ccc8f"  )

◆ push_back() [3537/4950]

x vTITEL push_back ( "PAWO_GW28Sep2005"  )

◆ push_back() [3538/4950]

x species_pp_version push_back ( "O_GW:PAW_LDA:28Sep2005"  )

◆ push_back() [3539/4950]

x species_pp_AUID push_back ( "d5fc66034c75667d"  )

◆ push_back() [3540/4950]

x species_pp_groundstate_structure push_back ( "N/A_d5fc66034c75667d"  )

◆ push_back() [3541/4950]

x vTITEL push_back ( "PAWO_h_GW22May2013"  )

◆ push_back() [3542/4950]

x species_pp push_back ( "O_h_GW"  )

◆ push_back() [3543/4950]

x species_pp_version push_back ( "O_h_GW:PAW_LDA:22May2013"  )

◆ push_back() [3544/4950]

x species_pp_AUID push_back ( "dcd65b1fb8d36f78"  )

◆ push_back() [3545/4950]

x species_pp_groundstate_structure push_back ( "N/A_dcd65b1fb8d36f78"  )

◆ push_back() [3546/4950]

x vTITEL push_back ( "PAWO_h10Feb2004"  )

◆ push_back() [3547/4950]

x species_pp_version push_back ( "O_h:PAW_LDA:10Feb2004"  )

◆ push_back() [3548/4950]

x species_pp_AUID push_back ( "f7923f8438142c43"  )

◆ push_back() [3549/4950]

x species_pp_groundstate_structure push_back ( "N/A_f7923f8438142c43"  )

◆ push_back() [3550/4950]

x vTITEL push_back ( "PAWO22Mar2012"  )

◆ push_back() [3551/4950]

x species_pp_version push_back ( "O:PAW_LDA:22Mar2012"  )

◆ push_back() [3552/4950]

x species_pp_AUID push_back ( "f34c733badbf3609"  )

◆ push_back() [3553/4950]

x species_pp_groundstate_structure push_back ( "N/A_f34c733badbf3609"  )

◆ push_back() [3554/4950]

x vTITEL push_back ( "PAWO_s_GW10Jan2007"  )

◆ push_back() [3555/4950]

x species_pp push_back ( "O_s_GW"  )

◆ push_back() [3556/4950]

x species_pp_version push_back ( "O_s_GW:PAW_LDA:10Jan2007"  )

◆ push_back() [3557/4950]

x species_pp_AUID push_back ( "88c1cdc4c1fccfd0"  )

◆ push_back() [3558/4950]

x species_pp_groundstate_structure push_back ( "N/A_88c1cdc4c1fccfd0"  )

◆ push_back() [3559/4950]

x species_pp_AUID push_back ( "543c974087b35e49"  )

◆ push_back() [3560/4950]

x species_pp_groundstate_structure push_back ( "N/A_543c974087b35e49"  )

◆ push_back() [3561/4950]

x species_pp_AUID push_back ( "3d2f9f5957efb0e2"  )

◆ push_back() [3562/4950]

x vTITEL push_back ( "PAWOs_pv28Mar2012"  )

◆ push_back() [3563/4950]

x species_pp_version push_back ( "Os_pv:PAW_LDA:28Mar2012"  )

◆ push_back() [3564/4950]

x species_pp_AUID push_back ( "9ce762cd7cd9b03f"  )

◆ push_back() [3565/4950]

x vTITEL push_back ( "PAWOs_sv_GW23Mar2010"  )

◆ push_back() [3566/4950]

x species_pp push_back ( "Os_sv_GW"  )

◆ push_back() [3567/4950]

x species_pp_version push_back ( "Os_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3568/4950]

x species_pp_AUID push_back ( "e444b49bdb1f5f2b"  )

◆ push_back() [3569/4950]

x vEATOM push_back ( 2513.  5855)

◆ push_back() [3570/4950]

x species_pp_AUID push_back ( "df773b708df533c7"  )

◆ push_back() [3571/4950]

x species_pp_groundstate_structure push_back ( "N/A_df773b708df533c7"  )

◆ push_back() [3572/4950]

x vEATOM push_back ( 1183.  9868)

◆ push_back() [3573/4950]

x species_pp_AUID push_back ( "d60f4ea95149428e"  )

◆ push_back() [3574/4950]

x species_pp_groundstate_structure push_back ( "N/A_d60f4ea95149428e"  )

◆ push_back() [3575/4950]

x vTITEL push_back ( "PAWPb_d_GW14Apr2014"  )

◆ push_back() [3576/4950]

x species_pp push_back ( "Pb_d_GW"  )

◆ push_back() [3577/4950]

x species_pp_version push_back ( "Pb_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3578/4950]

x species_pp_AUID push_back ( "e7d3c828acba821d"  )

◆ push_back() [3579/4950]

x vEATOM push_back ( 2533.  5573)

◆ push_back() [3580/4950]

x species_pp_AUID push_back ( "a50c38205409299f"  )

◆ push_back() [3581/4950]

x species_pp_AUID push_back ( "33aab1fdb40d3950"  )

◆ push_back() [3582/4950]

x vTITEL push_back ( "PAWPb_sv_GW04Apr2014"  )

◆ push_back() [3583/4950]

x species_pp push_back ( "Pb_sv_GW"  )

◆ push_back() [3584/4950]

x species_pp_version push_back ( "Pb_sv_GW:PAW_LDA:04Apr2014"  )

◆ push_back() [3585/4950]

x species_pp_AUID push_back ( "10185f68827f501a"  )

◆ push_back() [3586/4950]

x vEATOM push_back ( 5312.  0181)

◆ push_back() [3587/4950]

x vTITEL push_back ( "PAWPd_GW06Mar2008"  )

◆ push_back() [3588/4950]

x species_pp push_back ( "Pd_GW"  )

◆ push_back() [3589/4950]

x species_pp_version push_back ( "Pd_GW:PAW_LDA:06Mar2008"  )

◆ push_back() [3590/4950]

x species_pp_AUID push_back ( "d97ddcc6e311c95c"  )

◆ push_back() [3591/4950]

x vTITEL push_back ( "PAWPd04Jan2005"  )

◆ push_back() [3592/4950]

x species_pp_version push_back ( "Pd:PAW_LDA:04Jan2005"  )

◆ push_back() [3593/4950]

x species_pp_AUID push_back ( "310e1fd8b9174c88"  )

◆ push_back() [3594/4950]

x vTITEL push_back ( "PAWPd_pv28Jan2005"  )

◆ push_back() [3595/4950]

x species_pp_version push_back ( "Pd_pv:PAW_LDA:28Jan2005"  )

◆ push_back() [3596/4950]

x species_pp_AUID push_back ( "35af3e709779fcbb"  )

◆ push_back() [3597/4950]

x vTITEL push_back ( "PAWPd_sv_GW05Dec2013"  )

◆ push_back() [3598/4950]

x species_pp push_back ( "Pd_sv_GW"  )

◆ push_back() [3599/4950]

x species_pp_version push_back ( "Pd_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3600/4950]

x species_pp_AUID push_back ( "f8d2ab794f3a7628"  )

◆ push_back() [3601/4950]

x vTITEL push_back ( "PAWP_GW19Mar2012"  )

◆ push_back() [3602/4950]

x species_pp push_back ( "P_GW"  )

◆ push_back() [3603/4950]

x species_pp_version push_back ( "P_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [3604/4950]

x species_pp_AUID push_back ( "1be9fd0c3bec18f1"  )

◆ push_back() [3605/4950]

x species_pp_groundstate_structure push_back ( "N/A_1be9fd0c3bec18f1"  )

◆ push_back() [3606/4950]

x species_pp_AUID push_back ( "1b3e8ca8f74f9ff6"  )

◆ push_back() [3607/4950]

x species_pp_groundstate_structure push_back ( "N/A_1b3e8ca8f74f9ff6"  )

◆ push_back() [3608/4950]

x vTITEL push_back ( "PAWPo_d_GW14Apr2014"  )

◆ push_back() [3609/4950]

x species push_back ( "Po"  )

◆ push_back() [3610/4950]

x species_Z push_back ( 84  )

◆ push_back() [3611/4950]

x species_pp push_back ( "Po_d_GW"  )

◆ push_back() [3612/4950]

x species_pp_version push_back ( "Po_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3613/4950]

x species_pp_AUID push_back ( "95ec417249339b86"  )

◆ push_back() [3614/4950]

x species_pp_groundstate_structure push_back ( "N/A_95ec417249339b86"  )

◆ push_back() [3615/4950]

x vEATOM push_back ( 3315.  7421)

◆ push_back() [3616/4950]

x vTITEL push_back ( "PAWPo_d25May2007"  )

◆ push_back() [3617/4950]

x species_pp push_back ( "Po_d"  )

◆ push_back() [3618/4950]

x species_pp_version push_back ( "Po_d:PAW_LDA:25May2007"  )

◆ push_back() [3619/4950]

x species_pp_AUID push_back ( "b836c6dd57fc28b5"  )

◆ push_back() [3620/4950]

x species_pp_groundstate_structure push_back ( "N/A_b836c6dd57fc28b5"  )

◆ push_back() [3621/4950]

x vEATOM push_back ( 2290.  5524)

◆ push_back() [3622/4950]

x vTITEL push_back ( "PAWPo10Feb2004"  )

◆ push_back() [3623/4950]

x species_pp_version push_back ( "Po:PAW_LDA:10Feb2004"  )

◆ push_back() [3624/4950]

x species_pp_AUID push_back ( "46594f85714713cc"  )

◆ push_back() [3625/4950]

x species_pp_groundstate_structure push_back ( "N/A_46594f85714713cc"  )

◆ push_back() [3626/4950]

x vEATOM push_back ( 222.  5297)

◆ push_back() [3627/4950]

x vTITEL push_back ( "PAWPo_sv_GW14Apr2014"  )

◆ push_back() [3628/4950]

x species_pp push_back ( "Po_sv_GW"  )

◆ push_back() [3629/4950]

x species_pp_version push_back ( "Po_sv_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3630/4950]

x species_pp_AUID push_back ( "8606923ccc589741"  )

◆ push_back() [3631/4950]

x species_pp_groundstate_structure push_back ( "N/A_8606923ccc589741"  )

◆ push_back() [3632/4950]

x vEATOM push_back ( 6540.  2939)

◆ push_back() [3633/4950]

x vTITEL push_back ( "PAWP26Mar2009"  )

◆ push_back() [3634/4950]

x species_pp_version push_back ( "P:PAW_LDA:26Mar2009"  )

◆ push_back() [3635/4950]

x species_pp_AUID push_back ( "355f2427c0a3c263"  )

◆ push_back() [3636/4950]

x species_pp_groundstate_structure push_back ( "N/A_355f2427c0a3c263"  )

◆ push_back() [3637/4950]

x vTITEL push_back ( "PAWPt_f_GW10Mar2009"  )

◆ push_back() [3638/4950]

x species_pp push_back ( "Pt_f_GW"  )

◆ push_back() [3639/4950]

x species_pp_version push_back ( "Pt_f_GW:PAW_LDA:10Mar2009"  )

◆ push_back() [3640/4950]

x species_pp_AUID push_back ( "901eab88fea883a0"  )

◆ push_back() [3641/4950]

x vTITEL push_back ( "PAWPt_new15Nov2007"  )

◆ push_back() [3642/4950]

x species_pp push_back ( "Pt_new"  )

◆ push_back() [3643/4950]

x species_pp_version push_back ( "Pt_new:PAW_LDA:15Nov2007"  )

◆ push_back() [3644/4950]

x species_pp_AUID push_back ( "d5cf0a3860dcc78c"  )

◆ push_back() [3645/4950]

x vTITEL push_back ( "PAWPt_pv12Dec2005"  )

◆ push_back() [3646/4950]

x species_pp push_back ( "Pt_pv"  )

◆ push_back() [3647/4950]

x species_pp_version push_back ( "Pt_pv:PAW_LDA:12Dec2005"  )

◆ push_back() [3648/4950]

x species_pp_AUID push_back ( "693825ba67350fc5"  )

◆ push_back() [3649/4950]

x vEATOM push_back ( 2433.  2946)

◆ push_back() [3650/4950]

x vTITEL push_back ( "PAWPt_sv_GW23Mar2010"  )

◆ push_back() [3651/4950]

x species_pp push_back ( "Pt_sv_GW"  )

◆ push_back() [3652/4950]

x species_pp_version push_back ( "Pt_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3653/4950]

x species_pp_AUID push_back ( "15e78a872bbd5702"  )

◆ push_back() [3654/4950]

x vEATOM push_back ( 3300.  7158)

◆ push_back() [3655/4950]

x species_pp_AUID push_back ( "69cad8e764a91ff2"  )

◆ push_back() [3656/4950]

x species_pp_groundstate_structure push_back ( "N/A_69cad8e764a91ff2"  )

◆ push_back() [3657/4950]

x species_pp_AUID push_back ( "01a818d8dba4a24e"  )

◆ push_back() [3658/4950]

x species_pp_groundstate_structure push_back ( "N/A_01a818d8dba4a24e"  )

◆ push_back() [3659/4950]

x vTITEL push_back ( "PAWRa_sv29May2007"  )

◆ push_back() [3660/4950]

x species push_back ( "Ra"  )

◆ push_back() [3661/4950]

x species_Z push_back ( 88  )

◆ push_back() [3662/4950]

x species_pp push_back ( "Ra_sv"  )

◆ push_back() [3663/4950]

x species_pp_version push_back ( "Ra_sv:PAW_LDA:29May2007"  )

◆ push_back() [3664/4950]

x species_pp_AUID push_back ( "d42525be6c308fbc"  )

◆ push_back() [3665/4950]

x species_pp_groundstate_structure push_back ( "N/A_d42525be6c308fbc"  )

◆ push_back() [3666/4950]

x vEATOM push_back ( 666.  6157)

◆ push_back() [3667/4950]

x species_pp_AUID push_back ( "d007b72e2a56755e"  )

◆ push_back() [3668/4950]

x species_pp_groundstate_structure push_back ( "N/A_d007b72e2a56755e"  )

◆ push_back() [3669/4950]

x vTITEL push_back ( "PAWRb_sv_GW23Mar2010"  )

◆ push_back() [3670/4950]

x species_pp push_back ( "Rb_sv_GW"  )

◆ push_back() [3671/4950]

x species_pp_version push_back ( "Rb_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3672/4950]

x species_pp_AUID push_back ( "1618d2e74171564e"  )

◆ push_back() [3673/4950]

x species_pp_groundstate_structure push_back ( "N/A_1618d2e74171564e"  )

◆ push_back() [3674/4950]

x species_pp_AUID push_back ( "77942422f95e5a78"  )

◆ push_back() [3675/4950]

x species_pp_groundstate_structure push_back ( "N/A_77942422f95e5a78"  )

◆ push_back() [3676/4950]

x species_pp_AUID push_back ( "2e6c1204bb1f83d9"  )

◆ push_back() [3677/4950]

x species_pp_AUID push_back ( "330065ce03f40a48"  )

◆ push_back() [3678/4950]

x vTITEL push_back ( "PAWRe_sv_GW23Mar2010"  )

◆ push_back() [3679/4950]

x species_pp push_back ( "Re_sv_GW"  )

◆ push_back() [3680/4950]

x species_pp_version push_back ( "Re_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3681/4950]

x species_pp_AUID push_back ( "df4c77c476ac2743"  )

◆ push_back() [3682/4950]

x species_pp_groundstate_energy push_back ( -15.  37206)

◆ push_back() [3683/4950]

x vEATOM push_back ( 2173.  8076)

◆ push_back() [3684/4950]

x vTITEL push_back ( "PAWRh_GW06Mar2008"  )

◆ push_back() [3685/4950]

x species_pp push_back ( "Rh_GW"  )

◆ push_back() [3686/4950]

x species_pp_version push_back ( "Rh_GW:PAW_LDA:06Mar2008"  )

◆ push_back() [3687/4950]

x species_pp_AUID push_back ( "f67899f1f39d8de1"  )

◆ push_back() [3688/4950]

x vTITEL push_back ( "PAWRh04Feb2005"  )

◆ push_back() [3689/4950]

x species_pp_version push_back ( "Rh:PAW_LDA:04Feb2005"  )

◆ push_back() [3690/4950]

x species_pp_AUID push_back ( "8dec99af5c2e1b15"  )

◆ push_back() [3691/4950]

x vTITEL push_back ( "PAWRh_pv25Jan2005"  )

◆ push_back() [3692/4950]

x species_pp_version push_back ( "Rh_pv:PAW_LDA:25Jan2005"  )

◆ push_back() [3693/4950]

x species_pp_AUID push_back ( "c4a1fff764b83ce4"  )

◆ push_back() [3694/4950]

x vTITEL push_back ( "PAWRh_sv_GW05Dec2013"  )

◆ push_back() [3695/4950]

x species_pp push_back ( "Rh_sv_GW"  )

◆ push_back() [3696/4950]

x species_pp_version push_back ( "Rh_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3697/4950]

x species_pp_AUID push_back ( "786e475ef59bd566"  )

◆ push_back() [3698/4950]

x vEATOM push_back ( 3028.  7823)

◆ push_back() [3699/4950]

x vTITEL push_back ( "PAWRn_d_GW14Apr2014"  )

◆ push_back() [3700/4950]

x species push_back ( "Rn"  )

◆ push_back() [3701/4950]

x species_Z push_back ( 86  )

◆ push_back() [3702/4950]

x species_pp push_back ( "Rn_d_GW"  )

◆ push_back() [3703/4950]

x species_pp_version push_back ( "Rn_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3704/4950]

x species_pp_AUID push_back ( "393ab69c3cc7f29d"  )

◆ push_back() [3705/4950]

x species_pp_groundstate_structure push_back ( "N/A_393ab69c3cc7f29d"  )

◆ push_back() [3706/4950]

x vEATOM push_back ( 3035.  9385)

◆ push_back() [3707/4950]

x vTITEL push_back ( "PAWRn28Aug2006"  )

◆ push_back() [3708/4950]

x species_pp_version push_back ( "Rn:PAW_LDA:28Aug2006"  )

◆ push_back() [3709/4950]

x species_pp_AUID push_back ( "1286c15a3d8cba29"  )

◆ push_back() [3710/4950]

x species_pp_groundstate_structure push_back ( "N/A_1286c15a3d8cba29"  )

◆ push_back() [3711/4950]

x vEATOM push_back ( 415.  9777)

◆ push_back() [3712/4950]

x vTITEL push_back ( "PAWRn_sv_GW14Apr2014"  )

◆ push_back() [3713/4950]

x species_pp push_back ( "Rn_sv_GW"  )

◆ push_back() [3714/4950]

x species_pp_version push_back ( "Rn_sv_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3715/4950]

x species_pp_AUID push_back ( "32402773af596467"  )

◆ push_back() [3716/4950]

x species_pp_groundstate_structure push_back ( "N/A_32402773af596467"  )

◆ push_back() [3717/4950]

x vEATOM push_back ( 7931.  3492)

◆ push_back() [3718/4950]

x vTITEL push_back ( "PAWRu04Feb2005"  )

◆ push_back() [3719/4950]

x species_pp_version push_back ( "Ru:PAW_LDA:04Feb2005"  )

◆ push_back() [3720/4950]

x species_pp_AUID push_back ( "75e129c7fca73918"  )

◆ push_back() [3721/4950]

x vTITEL push_back ( "PAWRu_pv28Jan2005"  )

◆ push_back() [3722/4950]

x species_pp_version push_back ( "Ru_pv:PAW_LDA:28Jan2005"  )

◆ push_back() [3723/4950]

x species_pp_AUID push_back ( "d8a5660388ccadd7"  )

◆ push_back() [3724/4950]

x vTITEL push_back ( "PAWRu_sv_GW05Dec2013"  )

◆ push_back() [3725/4950]

x species_pp push_back ( "Ru_sv_GW"  )

◆ push_back() [3726/4950]

x species_pp_version push_back ( "Ru_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3727/4950]

x species_pp_AUID push_back ( "be15e79ed6e7404c"  )

◆ push_back() [3728/4950]

x vEATOM push_back ( 2598.  3141)

◆ push_back() [3729/4950]

x vTITEL push_back ( "PAWRu_sv28Jan2005"  )

◆ push_back() [3730/4950]

x species_pp_version push_back ( "Ru_sv:PAW_LDA:28Jan2005"  )

◆ push_back() [3731/4950]

x species_pp_AUID push_back ( "1be9ee7614ff5941"  )

◆ push_back() [3732/4950]

x vTITEL push_back ( "PAWSb_d_GW15Mar2013"  )

◆ push_back() [3733/4950]

x species_pp push_back ( "Sb_d_GW"  )

◆ push_back() [3734/4950]

x species_pp_version push_back ( "Sb_d_GW:PAW_LDA:15Mar2013"  )

◆ push_back() [3735/4950]

x species_pp_AUID push_back ( "30abc2bc95e77e5c"  )

◆ push_back() [3736/4950]

x species_pp_groundstate_structure push_back ( "N/A_30abc2bc95e77e5c"  )

◆ push_back() [3737/4950]

x vEATOM push_back ( 2247.  6425)

◆ push_back() [3738/4950]

x vTITEL push_back ( "PAWSb_GW21Mar2012"  )

◆ push_back() [3739/4950]

x species_pp push_back ( "Sb_GW"  )

◆ push_back() [3740/4950]

x species_pp_version push_back ( "Sb_GW:PAW_LDA:21Mar2012"  )

◆ push_back() [3741/4950]

x species_pp_AUID push_back ( "3dc3c615a6d6a151"  )

◆ push_back() [3742/4950]

x species_pp_groundstate_structure push_back ( "N/A_3dc3c615a6d6a151"  )

◆ push_back() [3743/4950]

x species_pp_AUID push_back ( "f5164fe3b9e81af7"  )

◆ push_back() [3744/4950]

x species_pp_groundstate_structure push_back ( "N/A_f5164fe3b9e81af7"  )

◆ push_back() [3745/4950]

x vTITEL push_back ( "PAWSb_sv_GW22Nov2013"  )

◆ push_back() [3746/4950]

x species_pp push_back ( "Sb_sv_GW"  )

◆ push_back() [3747/4950]

x species_pp_version push_back ( "Sb_sv_GW:PAW_LDA:22Nov2013"  )

◆ push_back() [3748/4950]

x species_pp_AUID push_back ( "2d9368ffe6a0826a"  )

◆ push_back() [3749/4950]

x species_pp_groundstate_structure push_back ( "N/A_2d9368ffe6a0826a"  )

◆ push_back() [3750/4950]

x vEATOM push_back ( 6574.  597)

◆ push_back() [3751/4950]

x vTITEL push_back ( "PAWSc26Mar2012"  )

◆ push_back() [3752/4950]

x species_pp_version push_back ( "Sc:PAW_LDA:26Mar2012"  )

◆ push_back() [3753/4950]

x species_pp_AUID push_back ( "2bfc025403470bd0"  )

◆ push_back() [3754/4950]

x vEATOM push_back ( 45.  3998)

◆ push_back() [3755/4950]

x vTITEL push_back ( "PAWSc_sv_GW05Dec2013"  )

◆ push_back() [3756/4950]

x species_pp push_back ( "Sc_sv_GW"  )

◆ push_back() [3757/4950]

x species_pp_version push_back ( "Sc_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3758/4950]

x species_pp_AUID push_back ( "94509e69a97fd6ec"  )

◆ push_back() [3759/4950]

x vEATOM push_back ( 1271.  508)

◆ push_back() [3760/4950]

x species_pp_AUID push_back ( "109c2eef02dea969"  )

◆ push_back() [3761/4950]

x vTITEL push_back ( "PAWSe_GW21Mar2012"  )

◆ push_back() [3762/4950]

x species_pp push_back ( "Se_GW"  )

◆ push_back() [3763/4950]

x species_pp_version push_back ( "Se_GW:PAW_LDA:21Mar2012"  )

◆ push_back() [3764/4950]

x species_pp_AUID push_back ( "4715390519b0428d"  )

◆ push_back() [3765/4950]

x species_pp_groundstate_structure push_back ( "N/A_4715390519b0428d"  )

◆ push_back() [3766/4950]

x species_pp_AUID push_back ( "3aa1bfa25d8777b4"  )

◆ push_back() [3767/4950]

x species_pp_groundstate_structure push_back ( "N/A_3aa1bfa25d8777b4"  )

◆ push_back() [3768/4950]

x vTITEL push_back ( "PAWSe_sv_GW21Nov2013"  )

◆ push_back() [3769/4950]

x species_pp push_back ( "Se_sv_GW"  )

◆ push_back() [3770/4950]

x species_pp_version push_back ( "Se_sv_GW:PAW_LDA:21Nov2013"  )

◆ push_back() [3771/4950]

x species_pp_AUID push_back ( "3e2fe80990b4a8cd"  )

◆ push_back() [3772/4950]

x species_pp_groundstate_structure push_back ( "N/A_3e2fe80990b4a8cd"  )

◆ push_back() [3773/4950]

x vEATOM push_back ( 10169.  2599)

◆ push_back() [3774/4950]

x vTITEL push_back ( "PAWS_GW19Mar2012"  )

◆ push_back() [3775/4950]

x species_pp push_back ( "S_GW"  )

◆ push_back() [3776/4950]

x species_pp_version push_back ( "S_GW:PAW_LDA:19Mar2012"  )

◆ push_back() [3777/4950]

x species_pp_AUID push_back ( "30119ef695ccbda6"  )

◆ push_back() [3778/4950]

x species_pp_groundstate_structure push_back ( "N/A_30119ef695ccbda6"  )

◆ push_back() [3779/4950]

x species_pp_AUID push_back ( "93cd9ba30f020fef"  )

◆ push_back() [3780/4950]

x species_pp_groundstate_structure push_back ( "N/A_93cd9ba30f020fef"  )

◆ push_back() [3781/4950]

x vTITEL push_back ( "PAWSi_GW04May2012"  )

◆ push_back() [3782/4950]

x species_pp push_back ( "Si_GW"  )

◆ push_back() [3783/4950]

x species_pp_version push_back ( "Si_GW:PAW_LDA:04May2012"  )

◆ push_back() [3784/4950]

x species_pp_AUID push_back ( "eecf31a13b93c733"  )

◆ push_back() [3785/4950]

x species_pp_groundstate_structure push_back ( "N/A_eecf31a13b93c733"  )

◆ push_back() [3786/4950]

x species_pp_AUID push_back ( "3b097b8080dbf343"  )

◆ push_back() [3787/4950]

x species_pp_groundstate_structure push_back ( "N/A_3b097b8080dbf343"  )

◆ push_back() [3788/4950]

x vTITEL push_back ( "PAWSi_sv_GW29Sep2009"  )

◆ push_back() [3789/4950]

x species_pp push_back ( "Si_sv_GW"  )

◆ push_back() [3790/4950]

x species_pp_version push_back ( "Si_sv_GW:PAW_LDA:29Sep2009"  )

◆ push_back() [3791/4950]

x species_pp_AUID push_back ( "e484e10fe026080c"  )

◆ push_back() [3792/4950]

x species_pp_groundstate_structure push_back ( "N/A_e484e10fe026080c"  )

◆ push_back() [3793/4950]

x vEATOM push_back ( 2774.  3982)

◆ push_back() [3794/4950]

x vTITEL push_back ( "PAWSn_d_GW15Mar2013"  )

◆ push_back() [3795/4950]

x species_pp push_back ( "Sn_d_GW"  )

◆ push_back() [3796/4950]

x species_pp_version push_back ( "Sn_d_GW:PAW_LDA:15Mar2013"  )

◆ push_back() [3797/4950]

x species_pp_AUID push_back ( "d3da2f1c2c73d8d2"  )

◆ push_back() [3798/4950]

x species_pp_groundstate_structure push_back ( "N/A_d3da2f1c2c73d8d2"  )

◆ push_back() [3799/4950]

x species_pp_AUID push_back ( "21834d16a1b7ea74"  )

◆ push_back() [3800/4950]

x species_pp_groundstate_structure push_back ( "N/A_21834d16a1b7ea74"  )

◆ push_back() [3801/4950]

x species_pp_AUID push_back ( "9c28ee08925d10f2"  )

◆ push_back() [3802/4950]

x species_pp_groundstate_structure push_back ( "N/A_9c28ee08925d10f2"  )

◆ push_back() [3803/4950]

x vTITEL push_back ( "PAWSn_sv_GW22Nov2013"  )

◆ push_back() [3804/4950]

x species_pp push_back ( "Sn_sv_GW"  )

◆ push_back() [3805/4950]

x species_pp_version push_back ( "Sn_sv_GW:PAW_LDA:22Nov2013"  )

◆ push_back() [3806/4950]

x species_pp_AUID push_back ( "1d9ca26d2739844b"  )

◆ push_back() [3807/4950]

x species_pp_groundstate_structure push_back ( "N/A_1d9ca26d2739844b"  )

◆ push_back() [3808/4950]

x vEATOM push_back ( 5866.  2298)

◆ push_back() [3809/4950]

x vTITEL push_back ( "PAWS27Mar2009"  )

◆ push_back() [3810/4950]

x species_pp_version push_back ( "S:PAW_LDA:27Mar2009"  )

◆ push_back() [3811/4950]

x species_pp_AUID push_back ( "e1404def783304fa"  )

◆ push_back() [3812/4950]

x species_pp_groundstate_structure push_back ( "N/A_e1404def783304fa"  )

◆ push_back() [3813/4950]

x vTITEL push_back ( "PAWSr_sv_GW23Mar2010"  )

◆ push_back() [3814/4950]

x species_pp push_back ( "Sr_sv_GW"  )

◆ push_back() [3815/4950]

x species_pp_version push_back ( "Sr_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3816/4950]

x species_pp_AUID push_back ( "413055480ee6327d"  )

◆ push_back() [3817/4950]

x vEATOM push_back ( 840.  7857)

◆ push_back() [3818/4950]

x species_pp_AUID push_back ( "0ef5f931a158c7cf"  )

◆ push_back() [3819/4950]

x species_pp_AUID push_back ( "5fb21f2d50782c0a"  )

◆ push_back() [3820/4950]

x species_pp_AUID push_back ( "c09ef008a3f0e9d6"  )

◆ push_back() [3821/4950]

x vTITEL push_back ( "PAWTa_sv_GW23Mar2010"  )

◆ push_back() [3822/4950]

x species_pp push_back ( "Ta_sv_GW"  )

◆ push_back() [3823/4950]

x species_pp_version push_back ( "Ta_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3824/4950]

x species_pp_AUID push_back ( "2d534c8fcbaedf16"  )

◆ push_back() [3825/4950]

x vEATOM push_back ( 1594.  7123)

◆ push_back() [3826/4950]

x vTITEL push_back ( "PAWTc04Feb2005"  )

◆ push_back() [3827/4950]

x species_pp_version push_back ( "Tc:PAW_LDA:04Feb2005"  )

◆ push_back() [3828/4950]

x species_pp_AUID push_back ( "7f49cada4f0d0649"  )

◆ push_back() [3829/4950]

x vTITEL push_back ( "PAWTc_pv04Feb2005"  )

◆ push_back() [3830/4950]

x species_pp_version push_back ( "Tc_pv:PAW_LDA:04Feb2005"  )

◆ push_back() [3831/4950]

x species_pp_AUID push_back ( "09d8862331cbb74e"  )

◆ push_back() [3832/4950]

x vTITEL push_back ( "PAWTc_sv_GW05Dec2013"  )

◆ push_back() [3833/4950]

x species_pp push_back ( "Tc_sv_GW"  )

◆ push_back() [3834/4950]

x species_pp_version push_back ( "Tc_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3835/4950]

x species_pp_AUID push_back ( "1c51ade7c2153ec3"  )

◆ push_back() [3836/4950]

x vEATOM push_back ( 2211.  1138)

◆ push_back() [3837/4950]

x vTITEL push_back ( "PAWTc_sv23Mar2010"  )

◆ push_back() [3838/4950]

x species_pp push_back ( "Tc_sv"  )

◆ push_back() [3839/4950]

x species_pp_version push_back ( "Tc_sv:PAW_LDA:23Mar2010"  )

◆ push_back() [3840/4950]

x species_pp_AUID push_back ( "89fc48286bd60f36"  )

◆ push_back() [3841/4950]

x vTITEL push_back ( "PAWTe_GW22Mar2012"  )

◆ push_back() [3842/4950]

x species_pp push_back ( "Te_GW"  )

◆ push_back() [3843/4950]

x species_pp_version push_back ( "Te_GW:PAW_LDA:22Mar2012"  )

◆ push_back() [3844/4950]

x species_pp_AUID push_back ( "b5b6ba1eddfaf1e0"  )

◆ push_back() [3845/4950]

x species_pp_groundstate_structure push_back ( "N/A_b5b6ba1eddfaf1e0"  )

◆ push_back() [3846/4950]

x species_pp_AUID push_back ( "22ab5824930e493e"  )

◆ push_back() [3847/4950]

x species_pp_groundstate_structure push_back ( "N/A_22ab5824930e493e"  )

◆ push_back() [3848/4950]

x vTITEL push_back ( "PAWTe_sv_GW22Nov2013"  )

◆ push_back() [3849/4950]

x species_pp push_back ( "Te_sv_GW"  )

◆ push_back() [3850/4950]

x species_pp_version push_back ( "Te_sv_GW:PAW_LDA:22Nov2013"  )

◆ push_back() [3851/4950]

x species_pp_AUID push_back ( "c977c6f822bcdbf0"  )

◆ push_back() [3852/4950]

x species_pp_groundstate_structure push_back ( "N/A_c977c6f822bcdbf0"  )

◆ push_back() [3853/4950]

x vEATOM push_back ( 7333.  7254)

◆ push_back() [3854/4950]

x species_pp_AUID push_back ( "4d355d06f2c00a6f"  )

◆ push_back() [3855/4950]

x species_pp_groundstate_structure push_back ( "N/A_4d355d06f2c00a6f"  )

◆ push_back() [3856/4950]

x species_pp_AUID push_back ( "76f6c95f07f6fe73"  )

◆ push_back() [3857/4950]

x species_pp_groundstate_structure push_back ( "N/A_76f6c95f07f6fe73"  )

◆ push_back() [3858/4950]

x species_pp_AUID push_back ( "6ac0bee4033365b9"  )

◆ push_back() [3859/4950]

x species_pp_AUID push_back ( "97a9b01629f53a13"  )

◆ push_back() [3860/4950]

x vTITEL push_back ( "PAWTi_sv_GW05Dec2013"  )

◆ push_back() [3861/4950]

x species_pp push_back ( "Ti_sv_GW"  )

◆ push_back() [3862/4950]

x species_pp_version push_back ( "Ti_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3863/4950]

x species_pp_AUID push_back ( "7fe2ca0acf938fa1"  )

◆ push_back() [3864/4950]

x vTITEL push_back ( "PAWTi_sv26Sep2005"  )

◆ push_back() [3865/4950]

x species_pp_version push_back ( "Ti_sv:PAW_LDA:26Sep2005"  )

◆ push_back() [3866/4950]

x species_pp_AUID push_back ( "24ae6dcc846ed9d1"  )

◆ push_back() [3867/4950]

x vTITEL push_back ( "PAWTl_d_GW14Apr2014"  )

◆ push_back() [3868/4950]

x species_pp push_back ( "Tl_d_GW"  )

◆ push_back() [3869/4950]

x species_pp_version push_back ( "Tl_d_GW:PAW_LDA:14Apr2014"  )

◆ push_back() [3870/4950]

x species_pp_AUID push_back ( "5ac8539f4fcdea84"  )

◆ push_back() [3871/4950]

x species_pp_groundstate_structure push_back ( "N/A_5ac8539f4fcdea84"  )

◆ push_back() [3872/4950]

x vEATOM push_back ( 2192.  479)

◆ push_back() [3873/4950]

x species_pp_AUID push_back ( "192f54a6ce31b619"  )

◆ push_back() [3874/4950]

x species_pp_groundstate_structure push_back ( "N/A_192f54a6ce31b619"  )

◆ push_back() [3875/4950]

x species_pp_AUID push_back ( "d7f5dff58e011801"  )

◆ push_back() [3876/4950]

x species_pp_groundstate_structure push_back ( "N/A_d7f5dff58e011801"  )

◆ push_back() [3877/4950]

x vTITEL push_back ( "PAWTl_sv_GW16Apr2014"  )

◆ push_back() [3878/4950]

x species_pp push_back ( "Tl_sv_GW"  )

◆ push_back() [3879/4950]

x species_pp_version push_back ( "Tl_sv_GW:PAW_LDA:16Apr2014"  )

◆ push_back() [3880/4950]

x species_pp_AUID push_back ( "4973cd7dd0159d25"  )

◆ push_back() [3881/4950]

x species_pp_groundstate_structure push_back ( "N/A_4973cd7dd0159d25"  )

◆ push_back() [3882/4950]

x vEATOM push_back ( 4756.  049)

◆ push_back() [3883/4950]

x species_pp_AUID push_back ( "d6d7d7ef9fa1dfb4"  )

◆ push_back() [3884/4950]

x species_pp_groundstate_structure push_back ( "N/A_d6d7d7ef9fa1dfb4"  )

◆ push_back() [3885/4950]

x species_pp_AUID push_back ( "d0cb941e31976e48"  )

◆ push_back() [3886/4950]

x species_pp_groundstate_structure push_back ( "N/A_d0cb941e31976e48"  )

◆ push_back() [3887/4950]

x species_pp_AUID push_back ( "ea63bd55cec65d9b"  )

◆ push_back() [3888/4950]

x species_pp_AUID push_back ( "48af57fd67c93591"  )

◆ push_back() [3889/4950]

x vTITEL push_back ( "PAWV_sv_GW05Dec2013"  )

◆ push_back() [3890/4950]

x species_pp push_back ( "V_sv_GW"  )

◆ push_back() [3891/4950]

x species_pp_version push_back ( "V_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3892/4950]

x species_pp_AUID push_back ( "243544817f53020d"  )

◆ push_back() [3893/4950]

x vEATOM push_back ( 1950.  9915)

◆ push_back() [3894/4950]

x vTITEL push_back ( "PAWV_sv02Aug2007"  )

◆ push_back() [3895/4950]

x species_pp_version push_back ( "V_sv:PAW_LDA:02Aug2007"  )

◆ push_back() [3896/4950]

x species_pp_AUID push_back ( "af90f4bc7d752a11"  )

◆ push_back() [3897/4950]

x species_pp_AUID push_back ( "78d442c6ee8e1864"  )

◆ push_back() [3898/4950]

x vTITEL push_back ( "PAWW_sv_GW23Mar2010"  )

◆ push_back() [3899/4950]

x species_pp push_back ( "W_sv_GW"  )

◆ push_back() [3900/4950]

x species_pp_version push_back ( "W_sv_GW:PAW_LDA:23Mar2010"  )

◆ push_back() [3901/4950]

x species_pp_AUID push_back ( "61a24681ec6520ee"  )

◆ push_back() [3902/4950]

x vEATOM push_back ( 1867.  9555)

◆ push_back() [3903/4950]

x vTITEL push_back ( "PAWW_sv04Sep2015"  )

◆ push_back() [3904/4950]

x species_pp push_back ( "W_sv"  )

◆ push_back() [3905/4950]

x species_pp_version push_back ( "W_sv:PAW_LDA:04Sep2015"  )

◆ push_back() [3906/4950]

x species_pp_AUID push_back ( "c5c6cbb458696867"  )

◆ push_back() [3907/4950]

x vEATOM push_back ( 1869.  6536)

◆ push_back() [3908/4950]

x vTITEL push_back ( "PAWXe_GW08Jan2009"  )

◆ push_back() [3909/4950]

x species_pp push_back ( "Xe_GW"  )

◆ push_back() [3910/4950]

x species_pp_version push_back ( "Xe_GW:PAW_LDA:08Jan2009"  )

◆ push_back() [3911/4950]

x species_pp_AUID push_back ( "19f27d9c55e59fb3"  )

◆ push_back() [3912/4950]

x species_pp_groundstate_structure push_back ( "N/A_19f27d9c55e59fb3"  )

◆ push_back() [3913/4950]

x species_pp_AUID push_back ( "d875a77e76448d9c"  )

◆ push_back() [3914/4950]

x species_pp_groundstate_structure push_back ( "N/A_d875a77e76448d9c"  )

◆ push_back() [3915/4950]

x vTITEL push_back ( "PAWXe_sv_GW17Apr2014"  )

◆ push_back() [3916/4950]

x species_pp push_back ( "Xe_sv_GW"  )

◆ push_back() [3917/4950]

x species_pp_version push_back ( "Xe_sv_GW:PAW_LDA:17Apr2014"  )

◆ push_back() [3918/4950]

x species_pp_AUID push_back ( "894f4706e1918464"  )

◆ push_back() [3919/4950]

x species_pp_groundstate_structure push_back ( "N/A_894f4706e1918464"  )

◆ push_back() [3920/4950]

x vEATOM push_back ( 9010.  6179)

◆ push_back() [3921/4950]

x vTITEL push_back ( "PAWY_sv_GW05Dec2013"  )

◆ push_back() [3922/4950]

x species_pp push_back ( "Y_sv_GW"  )

◆ push_back() [3923/4950]

x species_pp_version push_back ( "Y_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3924/4950]

x species_pp_AUID push_back ( "2db4b684eb247746"  )

◆ push_back() [3925/4950]

x vTITEL push_back ( "PAWY_sv25May2007"  )

◆ push_back() [3926/4950]

x species_pp_version push_back ( "Y_sv:PAW_LDA:25May2007"  )

◆ push_back() [3927/4950]

x species_pp_AUID push_back ( "1eae9b15c3704e56"  )

◆ push_back() [3928/4950]

x vTITEL push_back ( "PAWZn_GW09Oct2010"  )

◆ push_back() [3929/4950]

x species_pp push_back ( "Zn_GW"  )

◆ push_back() [3930/4950]

x species_pp_version push_back ( "Zn_GW:PAW_LDA:09Oct2010"  )

◆ push_back() [3931/4950]

x species_pp_AUID push_back ( "264df91d482e7eb1"  )

◆ push_back() [3932/4950]

x species_pp_AUID push_back ( "710533d0171c7210"  )

◆ push_back() [3933/4950]

x vTITEL push_back ( "PAWZn_sv_GW05Dec2013"  )

◆ push_back() [3934/4950]

x species_pp push_back ( "Zn_sv_GW"  )

◆ push_back() [3935/4950]

x species_pp_version push_back ( "Zn_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3936/4950]

x species_pp_AUID push_back ( "02e332a61a92f598"  )

◆ push_back() [3937/4950]

x vEATOM push_back ( 6195.  6466)

◆ push_back() [3938/4950]

x vTITEL push_back ( "PAWZr_sv_GW05Dec2013"  )

◆ push_back() [3939/4950]

x species_pp push_back ( "Zr_sv_GW"  )

◆ push_back() [3940/4950]

x species_pp_version push_back ( "Zr_sv_GW:PAW_LDA:05Dec2013"  )

◆ push_back() [3941/4950]

x species_pp_AUID push_back ( "1d3446a7830fa99e"  )

◆ push_back() [3942/4950]

x vTITEL push_back ( "PAWZr_sv04Jan2005"  )

◆ push_back() [3943/4950]

x species_pp_version push_back ( "Zr_sv:PAW_LDA:04Jan2005"  )

◆ push_back() [3944/4950]

x species_pp_AUID push_back ( "d9f9fc183b6567ac"  )

◆ push_back() [3945/4950]

x species_pp_AUID push_back ( "b35f9d074448e332"  )

◆ push_back() [3946/4950]

x vTITEL push_back ( "PAW_PBEAg_GW06Mar2008"  )

◆ push_back() [3947/4950]

x species_pp_version push_back ( "Ag_GW:PAW_PBE:06Mar2008"  )

◆ push_back() [3948/4950]

x species_pp_AUID push_back ( "42cafd70767f07e7"  )

◆ push_back() [3949/4950]

x vTITEL push_back ( "PAW_PBEAg02Apr2005"  )

◆ push_back() [3950/4950]

x species_pp_version push_back ( "Ag:PAW_PBE:02Apr2005"  )

◆ push_back() [3951/4950]

x species_pp_AUID push_back ( "cc0097ef8847f6c4"  )

◆ push_back() [3952/4950]

x vTITEL push_back ( "PAW_PBEAg_pv09Dec2005"  )

◆ push_back() [3953/4950]

x species_pp_version push_back ( "Ag_pv:PAW_PBE:09Dec2005"  )

◆ push_back() [3954/4950]

x species_pp_AUID push_back ( "f4452364bfcfa5d4"  )

◆ push_back() [3955/4950]

x vEATOM push_back ( 3061.  0398)

◆ push_back() [3956/4950]

x vTITEL push_back ( "PAW_PBEAg_sv_GW05Dec2013"  )

◆ push_back() [3957/4950]

x species_pp_version push_back ( "Ag_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [3958/4950]

x species_pp_AUID push_back ( "c2b59d1e03816af0"  )

◆ push_back() [3959/4950]

x vEATOM push_back ( 4025.  3137)

◆ push_back() [3960/4950]

x vTITEL push_back ( "PAW_PBEAl_GW19Mar2012"  )

◆ push_back() [3961/4950]

x species_pp_version push_back ( "Al_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [3962/4950]

x species_pp_AUID push_back ( "9ed43f446f226080"  )

◆ push_back() [3963/4950]

x species_pp_AUID push_back ( "35865a9b2b516833"  )

◆ push_back() [3964/4950]

x vTITEL push_back ( "PAW_PBEAl_sv_GW2Feb2008"  )

◆ push_back() [3965/4950]

x species_pp_version push_back ( "Al_sv_GW:PAW_PBE:2Feb2008"  )

◆ push_back() [3966/4950]

x species_pp_AUID push_back ( "ff45f346e944433a"  )

◆ push_back() [3967/4950]

x vEATOM push_back ( 2216.  7599)

◆ push_back() [3968/4950]

x vTITEL push_back ( "PAW_PBEAm08May2007"  )

◆ push_back() [3969/4950]

x species_pp_version push_back ( "Am:PAW_PBE:08May2007"  )

◆ push_back() [3970/4950]

x species_pp_AUID push_back ( "25eb76aae7e384ba"  )

◆ push_back() [3971/4950]

x species_pp_groundstate_structure push_back ( "N/A_25eb76aae7e384ba"  )

◆ push_back() [3972/4950]

x vEATOM push_back ( 2269.  8918)

◆ push_back() [3973/4950]

x vTITEL push_back ( "PAW_PBEAr_GW21Aug2013"  )

◆ push_back() [3974/4950]

x species_pp_version push_back ( "Ar_GW:PAW_PBE:21Aug2013"  )

◆ push_back() [3975/4950]

x species_pp_AUID push_back ( "efa3f1a7f900b645"  )

◆ push_back() [3976/4950]

x species_pp_AUID push_back ( "c50dbc48fec4befc"  )

◆ push_back() [3977/4950]

x vTITEL push_back ( "PAW_PBEAs_d11Apr2003"  )

◆ push_back() [3978/4950]

x species_pp_version push_back ( "As_d:PAW_PBE:11Apr2003"  )

◆ push_back() [3979/4950]

x species_pp_AUID push_back ( "1170cc199ae6ad79"  )

◆ push_back() [3980/4950]

x vEATOM push_back ( 3093.  7101)

◆ push_back() [3981/4950]

x vTITEL push_back ( "PAW_PBEAs_GW20Mar2012"  )

◆ push_back() [3982/4950]

x species_pp_version push_back ( "As_GW:PAW_PBE:20Mar2012"  )

◆ push_back() [3983/4950]

x species_pp_AUID push_back ( "25e638b6903e3cfb"  )

◆ push_back() [3984/4950]

x species_pp_groundstate_structure push_back ( "N/A_25e638b6903e3cfb"  )

◆ push_back() [3985/4950]

x vTITEL push_back ( "PAW_PBEAs22Sep2009"  )

◆ push_back() [3986/4950]

x species_pp_version push_back ( "As:PAW_PBE:22Sep2009"  )

◆ push_back() [3987/4950]

x species_pp_AUID push_back ( "b7b512c9cb6a6957"  )

◆ push_back() [3988/4950]

x species_pp_groundstate_structure push_back ( "N/A_b7b512c9cb6a6957"  )

◆ push_back() [3989/4950]

x vTITEL push_back ( "PAW_PBEAs_sv_GW05Dec2013"  )

◆ push_back() [3990/4950]

x species_pp_version push_back ( "As_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [3991/4950]

x species_pp_AUID push_back ( "bf6e1f55a327aa4c"  )

◆ push_back() [3992/4950]

x species_pp_groundstate_structure push_back ( "N/A_bf6e1f55a327aa4c"  )

◆ push_back() [3993/4950]

x vEATOM push_back ( 9061.  2473)

◆ push_back() [3994/4950]

x vTITEL push_back ( "PAW_PBEAt_d_GW14Apr2014"  )

◆ push_back() [3995/4950]

x species_pp_version push_back ( "At_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [3996/4950]

x species_pp_AUID push_back ( "78fa1df5724e2903"  )

◆ push_back() [3997/4950]

x species_pp_groundstate_structure push_back ( "N/A_78fa1df5724e2903"  )

◆ push_back() [3998/4950]

x vEATOM push_back ( 2642.  5492)

◆ push_back() [3999/4950]

x vTITEL push_back ( "PAW_PBEAt21May2007"  )

◆ push_back() [4000/4950]

x species_pp_version push_back ( "At:PAW_PBE:21May2007"  )

◆ push_back() [4001/4950]

x species_pp_AUID push_back ( "d5aeb6848f1218df"  )

◆ push_back() [4002/4950]

x species_pp_groundstate_structure push_back ( "N/A_d5aeb6848f1218df"  )

◆ push_back() [4003/4950]

x vEATOM push_back ( 307.  6057)

◆ push_back() [4004/4950]

x vTITEL push_back ( "PAW_PBEAt_sv_GW14Apr2014"  )

◆ push_back() [4005/4950]

x species_pp_version push_back ( "At_sv_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4006/4950]

x species_pp_AUID push_back ( "c5288820e6964522"  )

◆ push_back() [4007/4950]

x species_pp_groundstate_structure push_back ( "N/A_c5288820e6964522"  )

◆ push_back() [4008/4950]

x vEATOM push_back ( 7210.  2455)

◆ push_back() [4009/4950]

x vTITEL push_back ( "PAW_PBEAu_GW23Mar2010"  )

◆ push_back() [4010/4950]

x species_pp_version push_back ( "Au_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4011/4950]

x species_pp_AUID push_back ( "9f4c25db32e99a1b"  )

◆ push_back() [4012/4950]

x vTITEL push_back ( "PAW_PBEAu04Oct2007"  )

◆ push_back() [4013/4950]

x species_pp_version push_back ( "Au:PAW_PBE:04Oct2007"  )

◆ push_back() [4014/4950]

x species_pp_AUID push_back ( "e2936a3049f7d935"  )

◆ push_back() [4015/4950]

x vTITEL push_back ( "PAW_PBEAu_sv_GW13Sep2013"  )

◆ push_back() [4016/4950]

x species_pp_version push_back ( "Au_sv_GW:PAW_PBE:13Sep2013"  )

◆ push_back() [4017/4950]

x species_pp_AUID push_back ( "6db06caa45317191"  )

◆ push_back() [4018/4950]

x vEATOM push_back ( 3745.  9058)

◆ push_back() [4019/4950]

x vTITEL push_back ( "PAW_PBEBa_sv_GW23Mar2010"  )

◆ push_back() [4020/4950]

x species_pp_version push_back ( "Ba_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4021/4950]

x species_pp_AUID push_back ( "5b4abc32c2c70aaf"  )

◆ push_back() [4022/4950]

x vEATOM push_back ( 697.  9719)

◆ push_back() [4023/4950]

x species_pp_AUID push_back ( "63fd0fe091a069b0"  )

◆ push_back() [4024/4950]

x vTITEL push_back ( "PAW_PBEBe_GW04Mar2008"  )

◆ push_back() [4025/4950]

x species_pp_version push_back ( "Be_GW:PAW_PBE:04Mar2008"  )

◆ push_back() [4026/4950]

x species_pp_AUID push_back ( "9c7dbe99a9ffabaf"  )

◆ push_back() [4027/4950]

x species_pp_AUID push_back ( "b72167bbb69596d1"  )

◆ push_back() [4028/4950]

x vTITEL push_back ( "PAW_PBEBe_sv_GW31Mar2010"  )

◆ push_back() [4029/4950]

x species_pp_version push_back ( "Be_sv_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4030/4950]

x species_pp_AUID push_back ( "b68d3dd58972282d"  )

◆ push_back() [4031/4950]

x vEATOM push_back ( 390.  9322)

◆ push_back() [4032/4950]

x species_pp_AUID push_back ( "ca7aaa39015dc4f6"  )

◆ push_back() [4033/4950]

x vTITEL push_back ( "PAW_PBEB28Sep2005"  )

◆ push_back() [4034/4950]

x species_pp_version push_back ( "B:PAW_PBE:28Sep2005"  )

◆ push_back() [4035/4950]

x species_pp_AUID push_back ( "bf5d66ad65f5ca33"  )

◆ push_back() [4036/4950]

x species_pp_groundstate_structure push_back ( "N/A_bf5d66ad65f5ca33"  )

◆ push_back() [4037/4950]

x vTITEL push_back ( "PAW_PBEB_h06Feb2004"  )

◆ push_back() [4038/4950]

x species_pp_version push_back ( "B_h:PAW_PBE:06Feb2004"  )

◆ push_back() [4039/4950]

x species_pp_AUID push_back ( "97c23347b69407ee"  )

◆ push_back() [4040/4950]

x species_pp_groundstate_structure push_back ( "N/A_97c23347b69407ee"  )

◆ push_back() [4041/4950]

x vTITEL push_back ( "PAW_PBEBi_d_GW14Apr2014"  )

◆ push_back() [4042/4950]

x species_pp_version push_back ( "Bi_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4043/4950]

x species_pp_AUID push_back ( "ca91f8e52a5b8642"  )

◆ push_back() [4044/4950]

x species_pp_groundstate_structure push_back ( "N/A_ca91f8e52a5b8642"  )

◆ push_back() [4045/4950]

x vEATOM push_back ( 2906.  2133)

◆ push_back() [4046/4950]

x species_pp_AUID push_back ( "46860e6586f9539f"  )

◆ push_back() [4047/4950]

x vEATOM push_back ( 1959.  2045)

◆ push_back() [4048/4950]

x vTITEL push_back ( "PAW_PBEBi_GW07Mar2011"  )

◆ push_back() [4049/4950]

x species_pp_version push_back ( "Bi_GW:PAW_PBE:07Mar2011"  )

◆ push_back() [4050/4950]

x species_pp_AUID push_back ( "bcae13c3636f006f"  )

◆ push_back() [4051/4950]

x species_pp_groundstate_structure push_back ( "N/A_bcae13c3636f006f"  )

◆ push_back() [4052/4950]

x species_pp_AUID push_back ( "2efd860034c70e39"  )

◆ push_back() [4053/4950]

x vTITEL push_back ( "PAW_PBEBi_sv_GW14Apr2014"  )

◆ push_back() [4054/4950]

x species_pp_version push_back ( "Bi_sv_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4055/4950]

x species_pp_AUID push_back ( "94314f8f6ea4f354"  )

◆ push_back() [4056/4950]

x species_pp_groundstate_structure push_back ( "N/A_94314f8f6ea4f354"  )

◆ push_back() [4057/4950]

x vEATOM push_back ( 5901.  3342)

◆ push_back() [4058/4950]

x species_pp_AUID push_back ( "336166fe9cd34b36"  )

◆ push_back() [4059/4950]

x species_pp_groundstate_structure push_back ( "N/A_336166fe9cd34b36"  )

◆ push_back() [4060/4950]

x vTITEL push_back ( "PAW_PBEBr20Mar2012"  )

◆ push_back() [4061/4950]

x species_pp_version push_back ( "Br:PAW_PBE:20Mar2012"  )

◆ push_back() [4062/4950]

x species_pp_AUID push_back ( "62b7d3154b7c5233"  )

◆ push_back() [4063/4950]

x species_pp_groundstate_structure push_back ( "N/A_62b7d3154b7c5233"  )

◆ push_back() [4064/4950]

x species_pp_AUID push_back ( "42d23b031e31632a"  )

◆ push_back() [4065/4950]

x vTITEL push_back ( "PAW_PBEBr_sv_GW21Nov2013"  )

◆ push_back() [4066/4950]

x species_pp_version push_back ( "Br_sv_GW:PAW_PBE:21Nov2013"  )

◆ push_back() [4067/4950]

x species_pp_AUID push_back ( "33bdf1910c4ef8c1"  )

◆ push_back() [4068/4950]

x species_pp_groundstate_structure push_back ( "N/A_33bdf1910c4ef8c1"  )

◆ push_back() [4069/4950]

x vEATOM push_back ( 11361.  0459)

◆ push_back() [4070/4950]

x species_pp_AUID push_back ( "fb9590ec27479fb5"  )

◆ push_back() [4071/4950]

x species_pp_groundstate_structure push_back ( "N/A_fb9590ec27479fb5"  )

◆ push_back() [4072/4950]

x species_pp_AUID push_back ( "529aebe19b9289ea"  )

◆ push_back() [4073/4950]

x vTITEL push_back ( "PAW_PBECa_sv_GW31Mar2010"  )

◆ push_back() [4074/4950]

x species_pp_version push_back ( "Ca_sv_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4075/4950]

x species_pp_AUID push_back ( "5ecdefc3dd3c9a74"  )

◆ push_back() [4076/4950]

x species_pp_AUID push_back ( "818406d11e64bddc"  )

◆ push_back() [4077/4950]

x vTITEL push_back ( "PAW_PBECd_f_GW18May2010"  )

◆ push_back() [4078/4950]

x species_pp_version push_back ( "Cd_f_GW:PAW_PBE:18May2010"  )

◆ push_back() [4079/4950]

x species_pp_AUID push_back ( "8e504fb676bf06a4"  )

◆ push_back() [4080/4950]

x species_pp_AUID push_back ( "fdf368e153b383d1"  )

◆ push_back() [4081/4950]

x vTITEL push_back ( "PAW_PBECd_sv_GW16Apr2014"  )

◆ push_back() [4082/4950]

x species_pp_version push_back ( "Cd_sv_GW:PAW_PBE:16Apr2014"  )

◆ push_back() [4083/4950]

x species_pp_AUID push_back ( "43daba3719e5e3b4"  )

◆ push_back() [4084/4950]

x vEATOM push_back ( 4591.  9982)

◆ push_back() [4085/4950]

x species_pp_AUID push_back ( "a896fb0aac886619"  )

◆ push_back() [4086/4950]

x species_pp_groundstate_structure push_back ( "N/A_a896fb0aac886619"  )

◆ push_back() [4087/4950]

x vTITEL push_back ( "PAW_PBECe_GW26Mar2009"  )

◆ push_back() [4088/4950]

x species_pp_version push_back ( "Ce_GW:PAW_PBE:26Mar2009"  )

◆ push_back() [4089/4950]

x species_pp_AUID push_back ( "e8e06e22c9ef4c6b"  )

◆ push_back() [4090/4950]

x species_pp_groundstate_structure push_back ( "N/A_e8e06e22c9ef4c6b"  )

◆ push_back() [4091/4950]

x vTITEL push_back ( "PAW_PBECe_h03Mar2005"  )

◆ push_back() [4092/4950]

x species_pp_version push_back ( "Ce_h:PAW_PBE:03Mar2005"  )

◆ push_back() [4093/4950]

x species_pp_AUID push_back ( "24ba1850e358faff"  )

◆ push_back() [4094/4950]

x species_pp_groundstate_structure push_back ( "N/A_24ba1850e358faff"  )

◆ push_back() [4095/4950]

x vTITEL push_back ( "PAW_PBECe23Dec2003"  )

◆ push_back() [4096/4950]

x species_pp_version push_back ( "Ce:PAW_PBE:23Dec2003"  )

◆ push_back() [4097/4950]

x species_pp_AUID push_back ( "bc711278cc7e92ff"  )

◆ push_back() [4098/4950]

x species_pp_groundstate_structure push_back ( "N/A_bc711278cc7e92ff"  )

◆ push_back() [4099/4950]

x vTITEL push_back ( "PAW_PBECf17Oct2013"  )

◆ push_back() [4100/4950]

x species_pp push_back ( "Cf"  )

◆ push_back() [4101/4950]

x species_Z push_back ( 98  )

◆ push_back() [4102/4950]

x species_pp_version push_back ( "Cf:PAW_PBE:17Oct2013"  )

◆ push_back() [4103/4950]

x species_pp_AUID push_back ( "57667f761e17f3fb"  )

◆ push_back() [4104/4950]

x species_pp_groundstate_structure push_back ( "N/A_57667f761e17f3fb"  )

◆ push_back() [4105/4950]

x vEATOM push_back ( 3451.  576)

◆ push_back() [4106/4950]

x vTITEL push_back ( "PAW_PBEC_GW_new19Mar2012"  )

◆ push_back() [4107/4950]

x species_pp_version push_back ( "C_GW_new:PAW_PBE:19Mar2012"  )

◆ push_back() [4108/4950]

x species_pp_AUID push_back ( "e3cf976d4ae8eb31"  )

◆ push_back() [4109/4950]

x species_pp_groundstate_structure push_back ( "N/A_e3cf976d4ae8eb31"  )

◆ push_back() [4110/4950]

x vTITEL push_back ( "PAW_PBEC_GW28Sep2005"  )

◆ push_back() [4111/4950]

x species_pp_version push_back ( "C_GW:PAW_PBE:28Sep2005"  )

◆ push_back() [4112/4950]

x species_pp_AUID push_back ( "5888d673710478c7"  )

◆ push_back() [4113/4950]

x species_pp_groundstate_structure push_back ( "N/A_5888d673710478c7"  )

◆ push_back() [4114/4950]

x vTITEL push_back ( "PAW_PBEC_h_GW23May2013"  )

◆ push_back() [4115/4950]

x species_pp_version push_back ( "C_h_GW:PAW_PBE:23May2013"  )

◆ push_back() [4116/4950]

x species_pp_AUID push_back ( "74caa009ec2a132b"  )

◆ push_back() [4117/4950]

x species_pp_groundstate_structure push_back ( "N/A_74caa009ec2a132b"  )

◆ push_back() [4118/4950]

x vTITEL push_back ( "PAW_PBEC_h06Feb2004"  )

◆ push_back() [4119/4950]

x species_pp_version push_back ( "C_h:PAW_PBE:06Feb2004"  )

◆ push_back() [4120/4950]

x species_pp_AUID push_back ( "8397f0cab3a0348d"  )

◆ push_back() [4121/4950]

x species_pp_groundstate_structure push_back ( "N/A_8397f0cab3a0348d"  )

◆ push_back() [4122/4950]

x vTITEL push_back ( "PAW_PBECl_GW19Mar2012"  )

◆ push_back() [4123/4950]

x species_pp_version push_back ( "Cl_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [4124/4950]

x species_pp_AUID push_back ( "e4ed49a33fc3292a"  )

◆ push_back() [4125/4950]

x species_pp_groundstate_structure push_back ( "N/A_e4ed49a33fc3292a"  )

◆ push_back() [4126/4950]

x vTITEL push_back ( "PAW_PBECl_h21Jan2003"  )

◆ push_back() [4127/4950]

x species_pp_version push_back ( "Cl_h:PAW_PBE:21Jan2003"  )

◆ push_back() [4128/4950]

x species_pp_AUID push_back ( "406fa4825ee5548c"  )

◆ push_back() [4129/4950]

x species_pp_groundstate_structure push_back ( "N/A_406fa4825ee5548c"  )

◆ push_back() [4130/4950]

x vTITEL push_back ( "PAW_PBECl06Sep2000"  )

◆ push_back() [4131/4950]

x species_pp_version push_back ( "Cl:PAW_PBE:06Sep2000"  )

◆ push_back() [4132/4950]

x species_pp_AUID push_back ( "9d680135d96b4029"  )

◆ push_back() [4133/4950]

x vTITEL push_back ( "PAW_PBECm17Jan2011"  )

◆ push_back() [4134/4950]

x species_pp_version push_back ( "Cm:PAW_PBE:17Jan2011"  )

◆ push_back() [4135/4950]

x species_pp_AUID push_back ( "40812a655a4573e5"  )

◆ push_back() [4136/4950]

x species_pp_groundstate_structure push_back ( "N/A_40812a655a4573e5"  )

◆ push_back() [4137/4950]

x vEATOM push_back ( 2626.  4675)

◆ push_back() [4138/4950]

x vTITEL push_back ( "PAW_PBECo_GW31Mar2010"  )

◆ push_back() [4139/4950]

x species_pp_version push_back ( "Co_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4140/4950]

x species_pp_AUID push_back ( "57bd04e1209ca57e"  )

◆ push_back() [4141/4950]

x vTITEL push_back ( "PAW_PBECo02Aug2007"  )

◆ push_back() [4142/4950]

x species_pp_version push_back ( "Co:PAW_PBE:02Aug2007"  )

◆ push_back() [4143/4950]

x species_pp_AUID push_back ( "4cc3ed3cb4d06e66"  )

◆ push_back() [4144/4950]

x vTITEL push_back ( "PAW_PBECo_pv23Apr2009"  )

◆ push_back() [4145/4950]

x species_pp_version push_back ( "Co_pv:PAW_PBE:23Apr2009"  )

◆ push_back() [4146/4950]

x species_pp_AUID push_back ( "6d93f7d0ea628829"  )

◆ push_back() [4147/4950]

x vEATOM push_back ( 2948.  1334)

◆ push_back() [4148/4950]

x vTITEL push_back ( "PAW_PBECo_sv_GW05Dec2013"  )

◆ push_back() [4149/4950]

x species_pp_version push_back ( "Co_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4150/4950]

x species_pp_AUID push_back ( "86d7a01ba3c1b75e"  )

◆ push_back() [4151/4950]

x vEATOM push_back ( 3975.  571)

◆ push_back() [4152/4950]

x vTITEL push_back ( "PAW_PBECo_sv23Jul2007"  )

◆ push_back() [4153/4950]

x species_pp_version push_back ( "Co_sv:PAW_PBE:23Jul2007"  )

◆ push_back() [4154/4950]

x species_pp_AUID push_back ( "12d6a4385e456ff2"  )

◆ push_back() [4155/4950]

x species_pp_AUID push_back ( "f9bce748fcbf37b3"  )

◆ push_back() [4156/4950]

x species_pp_AUID push_back ( "46684a319ca854a2"  )

◆ push_back() [4157/4950]

x vTITEL push_back ( "PAW_PBECr_pv02Aug2007"  )

◆ push_back() [4158/4950]

x species_pp_version push_back ( "Cr_pv:PAW_PBE:02Aug2007"  )

◆ push_back() [4159/4950]

x species_pp_AUID push_back ( "d84af42941e8d51d"  )

◆ push_back() [4160/4950]

x vTITEL push_back ( "PAW_PBECr_sv_GW05Dec2013"  )

◆ push_back() [4161/4950]

x species_pp_version push_back ( "Cr_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4162/4950]

x species_pp_AUID push_back ( "145bfb04c18c9c72"  )

◆ push_back() [4163/4950]

x vEATOM push_back ( 2367.  442)

◆ push_back() [4164/4950]

x vTITEL push_back ( "PAW_PBECr_sv23Jul2007"  )

◆ push_back() [4165/4950]

x species_pp_version push_back ( "Cr_sv:PAW_PBE:23Jul2007"  )

◆ push_back() [4166/4950]

x species_pp_AUID push_back ( "c349e20347a8f61f"  )

◆ push_back() [4167/4950]

x vEATOM push_back ( 2369.  2049)

◆ push_back() [4168/4950]

x species_pp_AUID push_back ( "1d57714c5040b391"  )

◆ push_back() [4169/4950]

x species_pp_groundstate_structure push_back ( "N/A_1d57714c5040b391"  )

◆ push_back() [4170/4950]

x vTITEL push_back ( "PAW_PBECs_sv_GW23Mar2010"  )

◆ push_back() [4171/4950]

x species_pp_version push_back ( "Cs_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4172/4950]

x species_pp_AUID push_back ( "e33c8a4092f5c27c"  )

◆ push_back() [4173/4950]

x species_pp_AUID push_back ( "485f7a26842607ea"  )

◆ push_back() [4174/4950]

x vTITEL push_back ( "PAW_PBECu_GW19May2006"  )

◆ push_back() [4175/4950]

x species_pp_version push_back ( "Cu_GW:PAW_PBE:19May2006"  )

◆ push_back() [4176/4950]

x species_pp_AUID push_back ( "425c1e69fb1d3d12"  )

◆ push_back() [4177/4950]

x vTITEL push_back ( "PAW_PBECu22Jun2005"  )

◆ push_back() [4178/4950]

x species_pp_version push_back ( "Cu:PAW_PBE:22Jun2005"  )

◆ push_back() [4179/4950]

x species_pp_AUID push_back ( "34032e61f91e67dc"  )

◆ push_back() [4180/4950]

x species_pp_AUID push_back ( "2ce0157f813571ea"  )

◆ push_back() [4181/4950]

x vEATOM push_back ( 4120.  1201)

◆ push_back() [4182/4950]

x vTITEL push_back ( "PAW_PBECu_sv_GW05Dec2013"  )

◆ push_back() [4183/4950]

x species_pp_version push_back ( "Cu_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4184/4950]

x species_pp_AUID push_back ( "f99eb576b351d71c"  )

◆ push_back() [4185/4950]

x vEATOM push_back ( 5382.  7943)

◆ push_back() [4186/4950]

x species_pp_AUID push_back ( "b7037854f4315aa3"  )

◆ push_back() [4187/4950]

x vTITEL push_back ( "PAW_PBEDy23Dec2003"  )

◆ push_back() [4188/4950]

x species_pp_version push_back ( "Dy:PAW_PBE:23Dec2003"  )

◆ push_back() [4189/4950]

x species_pp_AUID push_back ( "06df93ed854cd141"  )

◆ push_back() [4190/4950]

x vEATOM push_back ( 4066.  1117)

◆ push_back() [4191/4950]

x species_pp_AUID push_back ( "dc455b24250827d7"  )

◆ push_back() [4192/4950]

x species_pp_groundstate_structure push_back ( "N/A_dc455b24250827d7"  )

◆ push_back() [4193/4950]

x species_pp_AUID push_back ( "26d7f1c7f6bbc798"  )

◆ push_back() [4194/4950]

x species_pp_groundstate_structure push_back ( "N/A_26d7f1c7f6bbc798"  )

◆ push_back() [4195/4950]

x vTITEL push_back ( "PAW_PBEEr01Sep2006"  )

◆ push_back() [4196/4950]

x species_pp_version push_back ( "Er:PAW_PBE:01Sep2006"  )

◆ push_back() [4197/4950]

x species_pp_AUID push_back ( "049459c5b5344f8b"  )

◆ push_back() [4198/4950]

x species_pp_groundstate_structure push_back ( "N/A_049459c5b5344f8b"  )

◆ push_back() [4199/4950]

x vEATOM push_back ( 5290.  6892)

◆ push_back() [4200/4950]

x species_pp_AUID push_back ( "a22a43bf65f9416c"  )

◆ push_back() [4201/4950]

x species_pp_groundstate_structure push_back ( "N/A_a22a43bf65f9416c"  )

◆ push_back() [4202/4950]

x vTITEL push_back ( "PAW_PBEEu_320Oct2008"  )

◆ push_back() [4203/4950]

x species_pp push_back ( "Eu_3"  )

◆ push_back() [4204/4950]

x species_pp_version push_back ( "Eu_3:PAW_PBE:20Oct2008"  )

◆ push_back() [4205/4950]

x species_pp_AUID push_back ( "9888d9dbb05d2627"  )

◆ push_back() [4206/4950]

x species_pp_groundstate_structure push_back ( "N/A_9888d9dbb05d2627"  )

◆ push_back() [4207/4950]

x vEATOM push_back ( 619.  7075)

◆ push_back() [4208/4950]

x vTITEL push_back ( "PAW_PBEEu23Dec2003"  )

◆ push_back() [4209/4950]

x species_pp_version push_back ( "Eu:PAW_PBE:23Dec2003"  )

◆ push_back() [4210/4950]

x species_pp_AUID push_back ( "2453fc28e3c2ebe1"  )

◆ push_back() [4211/4950]

x vTITEL push_back ( "PAW_PBEFe_GW31Mar2010"  )

◆ push_back() [4212/4950]

x species_pp_version push_back ( "Fe_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4213/4950]

x species_pp_AUID push_back ( "e976c0bff7b57001"  )

◆ push_back() [4214/4950]

x species_pp_AUID push_back ( "4d78633077b48d89"  )

◆ push_back() [4215/4950]

x vTITEL push_back ( "PAW_PBEFe_pv02Aug2007"  )

◆ push_back() [4216/4950]

x species_pp_version push_back ( "Fe_pv:PAW_PBE:02Aug2007"  )

◆ push_back() [4217/4950]

x species_pp_AUID push_back ( "c3ba95aef6c439d4"  )

◆ push_back() [4218/4950]

x vEATOM push_back ( 2457.  4239)

◆ push_back() [4219/4950]

x vTITEL push_back ( "PAW_PBEFe_sv_GW05Dec2013"  )

◆ push_back() [4220/4950]

x species_pp_version push_back ( "Fe_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4221/4950]

x species_pp_AUID push_back ( "e1d42714d0665eef"  )

◆ push_back() [4222/4950]

x vEATOM push_back ( 3376.  4015)

◆ push_back() [4223/4950]

x vTITEL push_back ( "PAW_PBEFe_sv23Jul2007"  )

◆ push_back() [4224/4950]

x species_pp_version push_back ( "Fe_sv:PAW_PBE:23Jul2007"  )

◆ push_back() [4225/4950]

x species_pp_AUID push_back ( "dbda82e42dec4a56"  )

◆ push_back() [4226/4950]

x vTITEL push_back ( "PAW_PBEF_GW19Mar2012"  )

◆ push_back() [4227/4950]

x species_pp_version push_back ( "F_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [4228/4950]

x species_pp_AUID push_back ( "6e1c9bfc69012b83"  )

◆ push_back() [4229/4950]

x species_pp_groundstate_structure push_back ( "N/A_6e1c9bfc69012b83"  )

◆ push_back() [4230/4950]

x vTITEL push_back ( "PAW_PBEF_GW21Dec2007"  )

◆ push_back() [4231/4950]

x species_pp_version push_back ( "F_GW:PAW_PBE:21Dec2007"  )

◆ push_back() [4232/4950]

x species_pp_AUID push_back ( "dd22cd7917da263b"  )

◆ push_back() [4233/4950]

x species_pp_groundstate_structure push_back ( "N/A_dd22cd7917da263b"  )

◆ push_back() [4234/4950]

x vTITEL push_back ( "PAW_PBEF_h_GW20May2014"  )

◆ push_back() [4235/4950]

x species_pp_version push_back ( "F_h_GW:PAW_PBE:20May2014"  )

◆ push_back() [4236/4950]

x species_pp_AUID push_back ( "fc9e05292b2c2b51"  )

◆ push_back() [4237/4950]

x species_pp_groundstate_structure push_back ( "N/A_fc9e05292b2c2b51"  )

◆ push_back() [4238/4950]

x vTITEL push_back ( "PAW_PBEF_h31May2013"  )

◆ push_back() [4239/4950]

x species_pp_version push_back ( "F_h:PAW_PBE:31May2013"  )

◆ push_back() [4240/4950]

x species_pp_AUID push_back ( "f0ad8fddee44ebe0"  )

◆ push_back() [4241/4950]

x species_pp_groundstate_structure push_back ( "N/A_f0ad8fddee44ebe0"  )

◆ push_back() [4242/4950]

x species_pp_AUID push_back ( "4c13232a0a03cdc4"  )

◆ push_back() [4243/4950]

x vTITEL push_back ( "PAW_PBEFr_sv29May2007"  )

◆ push_back() [4244/4950]

x species_pp_version push_back ( "Fr_sv:PAW_PBE:29May2007"  )

◆ push_back() [4245/4950]

x species_pp_AUID push_back ( "6020236667feb415"  )

◆ push_back() [4246/4950]

x species_pp_groundstate_structure push_back ( "N/A_6020236667feb415"  )

◆ push_back() [4247/4950]

x vEATOM push_back ( 530.  0704)

◆ push_back() [4248/4950]

x species_pp_AUID push_back ( "40288aed2fee849b"  )

◆ push_back() [4249/4950]

x species_pp_groundstate_structure push_back ( "N/A_40288aed2fee849b"  )

◆ push_back() [4250/4950]

x vTITEL push_back ( "PAW_PBEGa_d_GW15Mar2013"  )

◆ push_back() [4251/4950]

x species_pp_version push_back ( "Ga_d_GW:PAW_PBE:15Mar2013"  )

◆ push_back() [4252/4950]

x species_pp_AUID push_back ( "bbb162145b6bd33c"  )

◆ push_back() [4253/4950]

x species_pp_groundstate_structure push_back ( "N/A_bbb162145b6bd33c"  )

◆ push_back() [4254/4950]

x vTITEL push_back ( "PAW_PBEGa_d06Jul2010"  )

◆ push_back() [4255/4950]

x species_pp_version push_back ( "Ga_d:PAW_PBE:06Jul2010"  )

◆ push_back() [4256/4950]

x species_pp_AUID push_back ( "65b30f9555fb6b1c"  )

◆ push_back() [4257/4950]

x species_pp_groundstate_structure push_back ( "N/A_65b30f9555fb6b1c"  )

◆ push_back() [4258/4950]

x vTITEL push_back ( "PAW_PBEGa_GW22Mar2012"  )

◆ push_back() [4259/4950]

x species_pp_version push_back ( "Ga_GW:PAW_PBE:22Mar2012"  )

◆ push_back() [4260/4950]

x species_pp_AUID push_back ( "6f8d077fa793fae2"  )

◆ push_back() [4261/4950]

x species_pp_groundstate_structure push_back ( "N/A_6f8d077fa793fae2"  )

◆ push_back() [4262/4950]

x species_pp_AUID push_back ( "5a3627680584037d"  )

◆ push_back() [4263/4950]

x species_pp_AUID push_back ( "a76da45c5e0a0698"  )

◆ push_back() [4264/4950]

x species_pp_groundstate_structure push_back ( "N/A_a76da45c5e0a0698"  )

◆ push_back() [4265/4950]

x vTITEL push_back ( "PAW_PBEGa_sv_GW05Dec2013"  )

◆ push_back() [4266/4950]

x species_pp_version push_back ( "Ga_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4267/4950]

x species_pp_AUID push_back ( "38769eb274b76305"  )

◆ push_back() [4268/4950]

x species_pp_groundstate_structure push_back ( "N/A_38769eb274b76305"  )

◆ push_back() [4269/4950]

x species_pp_AUID push_back ( "c09d9d536dcd0d95"  )

◆ push_back() [4270/4950]

x species_pp_groundstate_structure push_back ( "N/A_c09d9d536dcd0d95"  )

◆ push_back() [4271/4950]

x vTITEL push_back ( "PAW_PBEGd23Dec2003"  )

◆ push_back() [4272/4950]

x species_pp_version push_back ( "Gd:PAW_PBE:23Dec2003"  )

◆ push_back() [4273/4950]

x species_pp_AUID push_back ( "c2d82aff5d614757"  )

◆ push_back() [4274/4950]

x species_pp_groundstate_structure push_back ( "N/A_c2d82aff5d614757"  )

◆ push_back() [4275/4950]

x vTITEL push_back ( "PAW_PBEGe_d_GW19Mar2013"  )

◆ push_back() [4276/4950]

x species_pp_version push_back ( "Ge_d_GW:PAW_PBE:19Mar2013"  )

◆ push_back() [4277/4950]

x species_pp_AUID push_back ( "75c9826c3428b4c4"  )

◆ push_back() [4278/4950]

x species_pp_groundstate_structure push_back ( "N/A_75c9826c3428b4c4"  )

◆ push_back() [4279/4950]

x vTITEL push_back ( "PAW_PBEGe_d03Jul2007"  )

◆ push_back() [4280/4950]

x species_pp_version push_back ( "Ge_d:PAW_PBE:03Jul2007"  )

◆ push_back() [4281/4950]

x species_pp_AUID push_back ( "18fa5cbdea403800"  )

◆ push_back() [4282/4950]

x vTITEL push_back ( "PAW_PBEGe04Okt2005"  )

◆ push_back() [4283/4950]

x species_pp_version push_back ( "Ge:PAW_PBE:04Okt2005"  )

◆ push_back() [4284/4950]

x species_pp_AUID push_back ( "e6b9c2ad0d26bc0f"  )

◆ push_back() [4285/4950]

x species_pp_groundstate_structure push_back ( "N/A_e6b9c2ad0d26bc0f"  )

◆ push_back() [4286/4950]

x species_pp_AUID push_back ( "571d96beea462000"  )

◆ push_back() [4287/4950]

x species_pp_AUID push_back ( "39a1162598519002"  )

◆ push_back() [4288/4950]

x vTITEL push_back ( "PAW_PBEGe_sv_GW26Apr2015"  )

◆ push_back() [4289/4950]

x species_pp_version push_back ( "Ge_sv_GW:PAW_PBE:26Apr2015"  )

◆ push_back() [4290/4950]

x species_pp_AUID push_back ( "61a3af8fc645731d"  )

◆ push_back() [4291/4950]

x species_pp_groundstate_structure push_back ( "N/A_61a3af8fc645731d"  )

◆ push_back() [4292/4950]

x species_pp_AUID push_back ( "5660d144f136f39f"  )

◆ push_back() [4293/4950]

x species_pp_groundstate_structure push_back ( "N/A_5660d144f136f39f"  )

◆ push_back() [4294/4950]

x vTITEL push_back ( "PAW_PBEH1.3306Jun2006"  )

◆ push_back() [4295/4950]

x species_pp_version push_back ( "H1.33:PAW_PBE:06Jun2006"  )

◆ push_back() [4296/4950]

x species_pp_AUID push_back ( "9fdd83e6541ae321"  )

◆ push_back() [4297/4950]

x species_pp_groundstate_structure push_back ( "N/A_9fdd83e6541ae321"  )

◆ push_back() [4298/4950]

x vEATOM push_back ( 26.  3038)

◆ push_back() [4299/4950]

x species_pp_AUID push_back ( "a491903d13282eca"  )

◆ push_back() [4300/4950]

x species_pp_groundstate_structure push_back ( "N/A_a491903d13282eca"  )

◆ push_back() [4301/4950]

x vTITEL push_back ( "PAW_PBEH1.6622Sep2006"  )

◆ push_back() [4302/4950]

x species_pp_version push_back ( "H1.66:PAW_PBE:22Sep2006"  )

◆ push_back() [4303/4950]

x species_pp_AUID push_back ( "d51966fd35c3edd8"  )

◆ push_back() [4304/4950]

x species_pp_groundstate_structure push_back ( "N/A_d51966fd35c3edd8"  )

◆ push_back() [4305/4950]

x vEATOM push_back ( 47.  5195)

◆ push_back() [4306/4950]

x vTITEL push_back ( "PAW_PBEH1.7505Aug2008"  )

◆ push_back() [4307/4950]

x species_pp_version push_back ( "H1.75:PAW_PBE:05Aug2008"  )

◆ push_back() [4308/4950]

x species_pp_AUID push_back ( "032478b6859fc23a"  )

◆ push_back() [4309/4950]

x species_pp_groundstate_structure push_back ( "N/A_032478b6859fc23a"  )

◆ push_back() [4310/4950]

x vTITEL push_back ( "PAW_PBEH.2505Aug2008"  )

◆ push_back() [4311/4950]

x species_pp_version push_back ( "H.25:PAW_PBE:05Aug2008"  )

◆ push_back() [4312/4950]

x species_pp_AUID push_back ( "99d35f31f0b791a6"  )

◆ push_back() [4313/4950]

x species_pp_groundstate_structure push_back ( "N/A_99d35f31f0b791a6"  )

◆ push_back() [4314/4950]

x vTITEL push_back ( "PAW_PBEH.3322Sep2006"  )

◆ push_back() [4315/4950]

x species_pp_version push_back ( "H.33:PAW_PBE:22Sep2006"  )

◆ push_back() [4316/4950]

x species_pp_AUID push_back ( "2ccc10b3a90dbcf9"  )

◆ push_back() [4317/4950]

x species_pp_groundstate_structure push_back ( "N/A_2ccc10b3a90dbcf9"  )

◆ push_back() [4318/4950]

x vTITEL push_back ( "PAW_PBEH.4219Jan2011"  )

◆ push_back() [4319/4950]

x species_pp_version push_back ( "H.42:PAW_PBE:19Jan2011"  )

◆ push_back() [4320/4950]

x species_pp_AUID push_back ( "6c9e8fad1accd91e"  )

◆ push_back() [4321/4950]

x species_pp_groundstate_structure push_back ( "N/A_6c9e8fad1accd91e"  )

◆ push_back() [4322/4950]

x vTITEL push_back ( "PAW_PBEH.5819Jan2011"  )

◆ push_back() [4323/4950]

x species_pp_version push_back ( "H.58:PAW_PBE:19Jan2011"  )

◆ push_back() [4324/4950]

x species_pp_AUID push_back ( "d9763328a95df298"  )

◆ push_back() [4325/4950]

x species_pp_groundstate_structure push_back ( "N/A_d9763328a95df298"  )

◆ push_back() [4326/4950]

x species_pp_AUID push_back ( "24fa09c55d72aff5"  )

◆ push_back() [4327/4950]

x species_pp_groundstate_structure push_back ( "N/A_24fa09c55d72aff5"  )

◆ push_back() [4328/4950]

x vTITEL push_back ( "PAW_PBEH.6606Jun2006"  )

◆ push_back() [4329/4950]

x species_pp_version push_back ( "H.66:PAW_PBE:06Jun2006"  )

◆ push_back() [4330/4950]

x species_pp_AUID push_back ( "516d5a45eae41179"  )

◆ push_back() [4331/4950]

x species_pp_groundstate_structure push_back ( "N/A_516d5a45eae41179"  )

◆ push_back() [4332/4950]

x species_pp_AUID push_back ( "3fc7e7290e960da3"  )

◆ push_back() [4333/4950]

x species_pp_groundstate_structure push_back ( "N/A_3fc7e7290e960da3"  )

◆ push_back() [4334/4950]

x species_pp_AUID push_back ( "245e65e58f54e060"  )

◆ push_back() [4335/4950]

x species_pp_groundstate_structure push_back ( "N/A_245e65e58f54e060"  )

◆ push_back() [4336/4950]

x species_pp_AUID push_back ( "fff57ead7f771a73"  )

◆ push_back() [4337/4950]

x species_pp_groundstate_structure push_back ( "N/A_fff57ead7f771a73"  )

◆ push_back() [4338/4950]

x vTITEL push_back ( "PAW_PBEHe_GW13May2007"  )

◆ push_back() [4339/4950]

x species_pp_version push_back ( "He_GW:PAW_PBE:13May2007"  )

◆ push_back() [4340/4950]

x species_pp_AUID push_back ( "c2203f9ac56998c3"  )

◆ push_back() [4341/4950]

x species_pp_groundstate_structure push_back ( "N/A_c2203f9ac56998c3"  )

◆ push_back() [4342/4950]

x species_pp_AUID push_back ( "41b6dfb79cfd01bf"  )

◆ push_back() [4343/4950]

x species_pp_groundstate_structure push_back ( "N/A_41b6dfb79cfd01bf"  )

◆ push_back() [4344/4950]

x species_pp_AUID push_back ( "b5f0d256277acd2b"  )

◆ push_back() [4345/4950]

x species_pp_AUID push_back ( "8be591141a9fad1a"  )

◆ push_back() [4346/4950]

x vTITEL push_back ( "PAW_PBEHf_sv_GW16Jan2015"  )

◆ push_back() [4347/4950]

x species_pp_version push_back ( "Hf_sv_GW:PAW_PBE:16Jan2015"  )

◆ push_back() [4348/4950]

x species_pp_AUID push_back ( "db6f396ed2ce01c6"  )

◆ push_back() [4349/4950]

x vEATOM push_back ( 1349.  7622)

◆ push_back() [4350/4950]

x vTITEL push_back ( "PAW_PBEHf_sv10Jan2008GWsuitable"  )

◆ push_back() [4351/4950]

x species_pp_version push_back ( "Hf_sv:PAW_PBE:10Jan2008"  )

◆ push_back() [4352/4950]

x species_pp_AUID push_back ( "d78f974a4747b7ff"  )

◆ push_back() [4353/4950]

x species_pp_groundstate_structure push_back ( "N/A_d78f974a4747b7ff"  )

◆ push_back() [4354/4950]

x species_pp_AUID push_back ( "56eba2b878545a76"  )

◆ push_back() [4355/4950]

x vTITEL push_back ( "PAW_PBEHg_sv_GW16Apr2014"  )

◆ push_back() [4356/4950]

x species_pp_version push_back ( "Hg_sv_GW:PAW_PBE:16Apr2014"  )

◆ push_back() [4357/4950]

x species_pp_AUID push_back ( "658034ab1dedfee3"  )

◆ push_back() [4358/4950]

x species_pp_groundstate_structure push_back ( "N/A_658034ab1dedfee3"  )

◆ push_back() [4359/4950]

x vEATOM push_back ( 4232.  142)

◆ push_back() [4360/4950]

x vTITEL push_back ( "PAW_PBEH_GW21Apr2008"  )

◆ push_back() [4361/4950]

x species_pp_version push_back ( "H_GW:PAW_PBE:21Apr2008"  )

◆ push_back() [4362/4950]

x species_pp_AUID push_back ( "9b21b24795322264"  )

◆ push_back() [4363/4950]

x species_pp_groundstate_structure push_back ( "N/A_9b21b24795322264"  )

◆ push_back() [4364/4950]

x vTITEL push_back ( "PAW_PBEH_h_GW21Apr2008"  )

◆ push_back() [4365/4950]

x species_pp_version push_back ( "H_h_GW:PAW_PBE:21Apr2008"  )

◆ push_back() [4366/4950]

x species_pp_AUID push_back ( "4533a293004ef2a7"  )

◆ push_back() [4367/4950]

x species_pp_groundstate_structure push_back ( "N/A_4533a293004ef2a7"  )

◆ push_back() [4368/4950]

x vTITEL push_back ( "PAW_PBEH_h06Feb2004"  )

◆ push_back() [4369/4950]

x species_pp_version push_back ( "H_h:PAW_PBE:06Feb2004"  )

◆ push_back() [4370/4950]

x species_pp_AUID push_back ( "fc5f27f27b7ff06a"  )

◆ push_back() [4371/4950]

x species_pp_groundstate_structure push_back ( "N/A_fc5f27f27b7ff06a"  )

◆ push_back() [4372/4950]

x species_pp_AUID push_back ( "141af062a506aee7"  )

◆ push_back() [4373/4950]

x vTITEL push_back ( "PAW_PBEHo23Dec2003"  )

◆ push_back() [4374/4950]

x species_pp_version push_back ( "Ho:PAW_PBE:23Dec2003"  )

◆ push_back() [4375/4950]

x species_pp_AUID push_back ( "9f2403f9b7c52d90"  )

◆ push_back() [4376/4950]

x species_pp_groundstate_structure push_back ( "N/A_9f2403f9b7c52d90"  )

◆ push_back() [4377/4950]

x vEATOM push_back ( 4651.  6279)

◆ push_back() [4378/4950]

x species_pp_AUID push_back ( "772cd4ac80b01737"  )

◆ push_back() [4379/4950]

x vTITEL push_back ( "PAW_PBEH_s15May2010"  )

◆ push_back() [4380/4950]

x species_pp_version push_back ( "H_s:PAW_PBE:15May2010"  )

◆ push_back() [4381/4950]

x species_pp_AUID push_back ( "830c26794a4ed082"  )

◆ push_back() [4382/4950]

x species_pp_groundstate_structure push_back ( "N/A_830c26794a4ed082"  )

◆ push_back() [4383/4950]

x vTITEL push_back ( "PAW_PBEI_GW12Mar2012"  )

◆ push_back() [4384/4950]

x species_pp_version push_back ( "I_GW:PAW_PBE:12Mar2012"  )

◆ push_back() [4385/4950]

x species_pp_AUID push_back ( "4f813200a4d162f9"  )

◆ push_back() [4386/4950]

x species_pp_groundstate_structure push_back ( "N/A_4f813200a4d162f9"  )

◆ push_back() [4387/4950]

x vTITEL push_back ( "PAW_PBEIn_d_GW15Mar2013"  )

◆ push_back() [4388/4950]

x species_pp_version push_back ( "In_d_GW:PAW_PBE:15Mar2013"  )

◆ push_back() [4389/4950]

x species_pp_AUID push_back ( "4d629a967dbccf09"  )

◆ push_back() [4390/4950]

x species_pp_groundstate_structure push_back ( "N/A_4d629a967dbccf09"  )

◆ push_back() [4391/4950]

x species_pp_AUID push_back ( "ff28085cf0ed0c70"  )

◆ push_back() [4392/4950]

x species_pp_AUID push_back ( "b26165280c5a6d7c"  )

◆ push_back() [4393/4950]

x species_pp_groundstate_structure push_back ( "N/A_b26165280c5a6d7c"  )

◆ push_back() [4394/4950]

x vTITEL push_back ( "PAW_PBEIn_sv_GW22Nov2013"  )

◆ push_back() [4395/4950]

x species_pp_version push_back ( "In_sv_GW:PAW_PBE:22Nov2013"  )

◆ push_back() [4396/4950]

x species_pp_AUID push_back ( "5f8a2432ba82f701"  )

◆ push_back() [4397/4950]

x species_pp_groundstate_structure push_back ( "N/A_5f8a2432ba82f701"  )

◆ push_back() [4398/4950]

x vEATOM push_back ( 5203.  57)

◆ push_back() [4399/4950]

x species_pp_AUID push_back ( "89deb5ffd67a7166"  )

◆ push_back() [4400/4950]

x species_pp_AUID push_back ( "be8b84b10c2543f2"  )

◆ push_back() [4401/4950]

x vTITEL push_back ( "PAW_PBEIr_sv_GW23Mar2010"  )

◆ push_back() [4402/4950]

x species_pp_version push_back ( "Ir_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4403/4950]

x species_pp_AUID push_back ( "016aa529c50df352"  )

◆ push_back() [4404/4950]

x vEATOM push_back ( 2883.  8065)

◆ push_back() [4405/4950]

x vTITEL push_back ( "PAW_PBEI_sv_GW22Nov2013"  )

◆ push_back() [4406/4950]

x species_pp_version push_back ( "I_sv_GW:PAW_PBE:22Nov2013"  )

◆ push_back() [4407/4950]

x species_pp_AUID push_back ( "0e32d3ef147c4026"  )

◆ push_back() [4408/4950]

x species_pp_groundstate_structure push_back ( "N/A_0e32d3ef147c4026"  )

◆ push_back() [4409/4950]

x vEATOM push_back ( 8142.  4355)

◆ push_back() [4410/4950]

x species_pp_AUID push_back ( "ef04627355867a05"  )

◆ push_back() [4411/4950]

x vTITEL push_back ( "PAW_PBEKr_GW21Aug2013"  )

◆ push_back() [4412/4950]

x species_pp_version push_back ( "Kr_GW:PAW_PBE:21Aug2013"  )

◆ push_back() [4413/4950]

x species_pp_AUID push_back ( "0223bfc3bf49edec"  )

◆ push_back() [4414/4950]

x species_pp_groundstate_structure push_back ( "N/A_0223bfc3bf49edec"  )

◆ push_back() [4415/4950]

x species_pp_AUID push_back ( "67f25832e0291180"  )

◆ push_back() [4416/4950]

x species_pp_groundstate_structure push_back ( "N/A_67f25832e0291180"  )

◆ push_back() [4417/4950]

x vTITEL push_back ( "PAW_PBEK_sv_GW31Mar2010"  )

◆ push_back() [4418/4950]

x species_pp_version push_back ( "K_sv_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4419/4950]

x species_pp_AUID push_back ( "ffbcf5d09569ab63"  )

◆ push_back() [4420/4950]

x vEATOM push_back ( 772.  5375)

◆ push_back() [4421/4950]

x species_pp_AUID push_back ( "3ac2263c1999fd5c"  )

◆ push_back() [4422/4950]

x vTITEL push_back ( "PAW_PBELa_GW16May2012"  )

◆ push_back() [4423/4950]

x species_pp_version push_back ( "La_GW:PAW_PBE:16May2012"  )

◆ push_back() [4424/4950]

x species_pp_AUID push_back ( "ff51171bdf527343"  )

◆ push_back() [4425/4950]

x species_pp_AUID push_back ( "4098c299a18eef08"  )

◆ push_back() [4426/4950]

x species_pp_AUID push_back ( "450ae928112e37cc"  )

◆ push_back() [4427/4950]

x vTITEL push_back ( "PAW_PBELi_AE_GW25Mar2010"  )

◆ push_back() [4428/4950]

x species_pp_version push_back ( "Li_AE_GW:PAW_PBE:25Mar2010"  )

◆ push_back() [4429/4950]

x species_pp_AUID push_back ( "66ecb6ec79d94c89"  )

◆ push_back() [4430/4950]

x vEATOM push_back ( 200.  9989)

◆ push_back() [4431/4950]

x vTITEL push_back ( "PAW_PBELi_GW11May2007"  )

◆ push_back() [4432/4950]

x species_pp_version push_back ( "Li_GW:PAW_PBE:11May2007"  )

◆ push_back() [4433/4950]

x species_pp_AUID push_back ( "98109ece1c9fcc5d"  )

◆ push_back() [4434/4950]

x species_pp_AUID push_back ( "84026814dcd62d7a"  )

◆ push_back() [4435/4950]

x vTITEL push_back ( "PAW_PBELi_sv_GW25Mar2010"  )

◆ push_back() [4436/4950]

x species_pp_version push_back ( "Li_sv_GW:PAW_PBE:25Mar2010"  )

◆ push_back() [4437/4950]

x species_pp_AUID push_back ( "15ba50edd26f214b"  )

◆ push_back() [4438/4950]

x vTITEL push_back ( "PAW_PBELi_sv10Sep2004"  )

◆ push_back() [4439/4950]

x species_pp_version push_back ( "Li_sv:PAW_PBE:10Sep2004"  )

◆ push_back() [4440/4950]

x species_pp_AUID push_back ( "fbd8e4887832ff54"  )

◆ push_back() [4441/4950]

x species_pp_AUID push_back ( "61338e3aafb575ed"  )

◆ push_back() [4442/4950]

x species_pp_groundstate_structure push_back ( "N/A_61338e3aafb575ed"  )

◆ push_back() [4443/4950]

x vTITEL push_back ( "PAW_PBELu23Dec2003"  )

◆ push_back() [4444/4950]

x species_pp_version push_back ( "Lu:PAW_PBE:23Dec2003"  )

◆ push_back() [4445/4950]

x species_pp_AUID push_back ( "2eded4cf2dbc5fcb"  )

◆ push_back() [4446/4950]

x species_pp_groundstate_structure push_back ( "N/A_2eded4cf2dbc5fcb"  )

◆ push_back() [4447/4950]

x vTITEL push_back ( "PAW_PBEMg_GW13Apr2007"  )

◆ push_back() [4448/4950]

x species_pp_version push_back ( "Mg_GW:PAW_PBE:13Apr2007"  )

◆ push_back() [4449/4950]

x species_pp_AUID push_back ( "de8b5248bd86b871"  )

◆ push_back() [4450/4950]

x vTITEL push_back ( "PAW_PBEMg13Apr2007"  )

◆ push_back() [4451/4950]

x species_pp_version push_back ( "Mg:PAW_PBE:13Apr2007"  )

◆ push_back() [4452/4950]

x species_pp_AUID push_back ( "2c5dfb19cf1554e5"  )

◆ push_back() [4453/4950]

x vTITEL push_back ( "PAW_PBEMg_pv_GW20Apr2010"  )

◆ push_back() [4454/4950]

x species_pp_version push_back ( "Mg_pv_GW:PAW_PBE:20Apr2010"  )

◆ push_back() [4455/4950]

x species_pp_AUID push_back ( "149749856a0edabd"  )

◆ push_back() [4456/4950]

x vTITEL push_back ( "PAW_PBEMg_pv13Apr2007"  )

◆ push_back() [4457/4950]

x species_pp_version push_back ( "Mg_pv:PAW_PBE:13Apr2007"  )

◆ push_back() [4458/4950]

x species_pp_AUID push_back ( "26735ac174693885"  )

◆ push_back() [4459/4950]

x vTITEL push_back ( "PAW_PBEMg_sv_GW20Apr2010"  )

◆ push_back() [4460/4950]

x species_pp_version push_back ( "Mg_sv_GW:PAW_PBE:20Apr2010"  )

◆ push_back() [4461/4950]

x species_pp_AUID push_back ( "d42c93affd861a85"  )

◆ push_back() [4462/4950]

x vEATOM push_back ( 1714.  3102)

◆ push_back() [4463/4950]

x vTITEL push_back ( "PAW_PBEMg_sv12Apr2007"  )

◆ push_back() [4464/4950]

x species_pp_version push_back ( "Mg_sv:PAW_PBE:12Apr2007"  )

◆ push_back() [4465/4950]

x species_pp_AUID push_back ( "9d41ca07323da062"  )

◆ push_back() [4466/4950]

x vEATOM push_back ( 1728.  4457)

◆ push_back() [4467/4950]

x vTITEL push_back ( "PAW_PBEMn_GW31Mar2010"  )

◆ push_back() [4468/4950]

x species_pp_version push_back ( "Mn_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4469/4950]

x species_pp_AUID push_back ( "e51b7c7e43b3cc1e"  )

◆ push_back() [4470/4950]

x species_pp_groundstate_structure push_back ( "N/A_e51b7c7e43b3cc1e"  )

◆ push_back() [4471/4950]

x species_pp_AUID push_back ( "47732958260bfe13"  )

◆ push_back() [4472/4950]

x vTITEL push_back ( "PAW_PBEMn_pv02Aug2007"  )

◆ push_back() [4473/4950]

x species_pp_version push_back ( "Mn_pv:PAW_PBE:02Aug2007"  )

◆ push_back() [4474/4950]

x species_pp_AUID push_back ( "392051866cb4fe60"  )

◆ push_back() [4475/4950]

x vEATOM push_back ( 2025.  2664)

◆ push_back() [4476/4950]

x vTITEL push_back ( "PAW_PBEMn_sv_GW05Dec2013"  )

◆ push_back() [4477/4950]

x species_pp_version push_back ( "Mn_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4478/4950]

x species_pp_AUID push_back ( "facd8644d306249a"  )

◆ push_back() [4479/4950]

x species_pp_groundstate_structure push_back ( "N/A_facd8644d306249a"  )

◆ push_back() [4480/4950]

x vEATOM push_back ( 2841.  612)

◆ push_back() [4481/4950]

x vTITEL push_back ( "PAW_PBEMn_sv23Jul2007"  )

◆ push_back() [4482/4950]

x species_pp_version push_back ( "Mn_sv:PAW_PBE:23Jul2007"  )

◆ push_back() [4483/4950]

x species_pp_AUID push_back ( "1f1927349f5e4cba"  )

◆ push_back() [4484/4950]

x species_pp_groundstate_structure push_back ( "N/A_1f1927349f5e4cba"  )

◆ push_back() [4485/4950]

x vEATOM push_back ( 2843.  1506)

◆ push_back() [4486/4950]

x species_pp_AUID push_back ( "0808a3790788f802"  )

◆ push_back() [4487/4950]

x vTITEL push_back ( "PAW_PBEMo_pv04Feb2005"  )

◆ push_back() [4488/4950]

x species_pp_version push_back ( "Mo_pv:PAW_PBE:04Feb2005"  )

◆ push_back() [4489/4950]

x species_pp_AUID push_back ( "5001e3854b3663c0"  )

◆ push_back() [4490/4950]

x vTITEL push_back ( "PAW_PBEMo_sv_GW05Dec2013"  )

◆ push_back() [4491/4950]

x species_pp_version push_back ( "Mo_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4492/4950]

x species_pp_AUID push_back ( "9e3e9147c43cf059"  )

◆ push_back() [4493/4950]

x vEATOM push_back ( 1861.  5185)

◆ push_back() [4494/4950]

x vTITEL push_back ( "PAW_PBEMo_sv02Feb2006"  )

◆ push_back() [4495/4950]

x species_pp_version push_back ( "Mo_sv:PAW_PBE:02Feb2006"  )

◆ push_back() [4496/4950]

x species_pp_AUID push_back ( "eb2ad6b5ae2c88f9"  )

◆ push_back() [4497/4950]

x vEATOM push_back ( 1862.  2866)

◆ push_back() [4498/4950]

x species_pp_AUID push_back ( "63e83f9cf84ac969"  )

◆ push_back() [4499/4950]

x vTITEL push_back ( "PAW_PBENa_pv19Sep2006"  )

◆ push_back() [4500/4950]

x species_pp_version push_back ( "Na_pv:PAW_PBE:19Sep2006"  )

◆ push_back() [4501/4950]

x species_pp_AUID push_back ( "86f3cf1cb9c67ee6"  )

◆ push_back() [4502/4950]

x vTITEL push_back ( "PAW_PBENa_sv_GW11May2015"  )

◆ push_back() [4503/4950]

x species_pp_version push_back ( "Na_sv_GW:PAW_PBE:11May2015"  )

◆ push_back() [4504/4950]

x species_pp_AUID push_back ( "3455418d35853cd4"  )

◆ push_back() [4505/4950]

x species_pp_AUID push_back ( "1c8fc7a7d87f9aa3"  )

◆ push_back() [4506/4950]

x species_pp_AUID push_back ( "2d2f42f890bd3354"  )

◆ push_back() [4507/4950]

x vTITEL push_back ( "PAW_PBENb_sv_GW05Dec2013"  )

◆ push_back() [4508/4950]

x species_pp_version push_back ( "Nb_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4509/4950]

x species_pp_AUID push_back ( "7a3805e4c05d950e"  )

◆ push_back() [4510/4950]

x vEATOM push_back ( 1553.  9121)

◆ push_back() [4511/4950]

x vTITEL push_back ( "PAW_PBENb_sv25May2007"  )

◆ push_back() [4512/4950]

x species_pp_version push_back ( "Nb_sv:PAW_PBE:25May2007"  )

◆ push_back() [4513/4950]

x species_pp_AUID push_back ( "b383f09c3645c1a5"  )

◆ push_back() [4514/4950]

x species_pp_AUID push_back ( "c5c0dee4eae029ea"  )

◆ push_back() [4515/4950]

x species_pp_groundstate_structure push_back ( "N/A_c5c0dee4eae029ea"  )

◆ push_back() [4516/4950]

x vTITEL push_back ( "PAW_PBENd23Dec2003"  )

◆ push_back() [4517/4950]

x species_pp_version push_back ( "Nd:PAW_PBE:23Dec2003"  )

◆ push_back() [4518/4950]

x species_pp_AUID push_back ( "f7eb1f2e26efb8ad"  )

◆ push_back() [4519/4950]

x species_pp_groundstate_structure push_back ( "N/A_f7eb1f2e26efb8ad"  )

◆ push_back() [4520/4950]

x vTITEL push_back ( "PAW_PBENe_GW22Sep2014"  )

◆ push_back() [4521/4950]

x species_pp_version push_back ( "Ne_GW:PAW_PBE:22Sep2014"  )

◆ push_back() [4522/4950]

x species_pp_AUID push_back ( "42320e2cde3e888a"  )

◆ push_back() [4523/4950]

x species_pp_AUID push_back ( "326c9a1ee646c679"  )

◆ push_back() [4524/4950]

x vTITEL push_back ( "PAW_PBENe_GW02Oct2006"  )

◆ push_back() [4525/4950]

x species_pp_version push_back ( "Ne_GW:PAW_PBE:02Oct2006"  )

◆ push_back() [4526/4950]

x species_pp_AUID push_back ( "f46c79223af4d753"  )

◆ push_back() [4527/4950]

x vTITEL push_back ( "PAW_PBEN_GW_new19Mar2012"  )

◆ push_back() [4528/4950]

x species_pp_version push_back ( "N_GW_new:PAW_PBE:19Mar2012"  )

◆ push_back() [4529/4950]

x species_pp_AUID push_back ( "77e618735d9868c4"  )

◆ push_back() [4530/4950]

x species_pp_groundstate_structure push_back ( "N/A_77e618735d9868c4"  )

◆ push_back() [4531/4950]

x vTITEL push_back ( "PAW_PBEN_GW10Apr2007"  )

◆ push_back() [4532/4950]

x species_pp_version push_back ( "N_GW:PAW_PBE:10Apr2007"  )

◆ push_back() [4533/4950]

x species_pp_AUID push_back ( "35dfb36257fdf416"  )

◆ push_back() [4534/4950]

x species_pp_groundstate_structure push_back ( "N/A_35dfb36257fdf416"  )

◆ push_back() [4535/4950]

x vTITEL push_back ( "PAW_PBEN_h_GW03Jul2013"  )

◆ push_back() [4536/4950]

x species_pp_version push_back ( "N_h_GW:PAW_PBE:03Jul2013"  )

◆ push_back() [4537/4950]

x species_pp_AUID push_back ( "5290ff08f449e477"  )

◆ push_back() [4538/4950]

x species_pp_groundstate_structure push_back ( "N/A_5290ff08f449e477"  )

◆ push_back() [4539/4950]

x vTITEL push_back ( "PAW_PBEN_h06Feb2004"  )

◆ push_back() [4540/4950]

x species_pp_version push_back ( "N_h:PAW_PBE:06Feb2004"  )

◆ push_back() [4541/4950]

x species_pp_AUID push_back ( "da72fc6f8493acab"  )

◆ push_back() [4542/4950]

x species_pp_groundstate_structure push_back ( "N/A_da72fc6f8493acab"  )

◆ push_back() [4543/4950]

x vTITEL push_back ( "PAW_PBENi_GW31Mar2010"  )

◆ push_back() [4544/4950]

x species_pp_version push_back ( "Ni_GW:PAW_PBE:31Mar2010"  )

◆ push_back() [4545/4950]

x species_pp_AUID push_back ( "fd7da3695dd95380"  )

◆ push_back() [4546/4950]

x vTITEL push_back ( "PAW_PBENi02Aug2007"  )

◆ push_back() [4547/4950]

x species_pp_version push_back ( "Ni:PAW_PBE:02Aug2007"  )

◆ push_back() [4548/4950]

x species_pp_AUID push_back ( "1f50d23b4fbbe9d3"  )

◆ push_back() [4549/4950]

x species_pp_AUID push_back ( "1141cd9c7118591b"  )

◆ push_back() [4550/4950]

x vEATOM push_back ( 3501.  123)

◆ push_back() [4551/4950]

x vTITEL push_back ( "PAW_PBENi_sv_GW05Dec2013"  )

◆ push_back() [4552/4950]

x species_pp_version push_back ( "Ni_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4553/4950]

x species_pp_AUID push_back ( "510ec32ec7300763"  )

◆ push_back() [4554/4950]

x vEATOM push_back ( 4642.  8712)

◆ push_back() [4555/4950]

x species_pp_AUID push_back ( "4ce4637079c90d89"  )

◆ push_back() [4556/4950]

x species_pp_AUID push_back ( "518ecaea65084905"  )

◆ push_back() [4557/4950]

x species_pp_groundstate_structure push_back ( "N/A_518ecaea65084905"  )

◆ push_back() [4558/4950]

x vEATOM push_back ( 1660.  912)

◆ push_back() [4559/4950]

x species_pp_AUID push_back ( "09c65979f456eaf1"  )

◆ push_back() [4560/4950]

x species_pp_groundstate_structure push_back ( "N/A_09c65979f456eaf1"  )

◆ push_back() [4561/4950]

x vTITEL push_back ( "PAW_PBEN_s_GW04Apr2007"  )

◆ push_back() [4562/4950]

x species_pp_version push_back ( "N_s_GW:PAW_PBE:04Apr2007"  )

◆ push_back() [4563/4950]

x species_pp_AUID push_back ( "bce8f545ef7c01f1"  )

◆ push_back() [4564/4950]

x species_pp_groundstate_structure push_back ( "N/A_bce8f545ef7c01f1"  )

◆ push_back() [4565/4950]

x species_pp_AUID push_back ( "82a6b4e26c173813"  )

◆ push_back() [4566/4950]

x species_pp_groundstate_structure push_back ( "N/A_82a6b4e26c173813"  )

◆ push_back() [4567/4950]

x vTITEL push_back ( "PAW_PBEO_GW19Mar2012"  )

◆ push_back() [4568/4950]

x species_pp_version push_back ( "O_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [4569/4950]

x species_pp_AUID push_back ( "0f54838fe49a9c57"  )

◆ push_back() [4570/4950]

x species_pp_groundstate_structure push_back ( "N/A_0f54838fe49a9c57"  )

◆ push_back() [4571/4950]

x vTITEL push_back ( "PAW_PBEO_GW28Sep2005"  )

◆ push_back() [4572/4950]

x species_pp_version push_back ( "O_GW:PAW_PBE:28Sep2005"  )

◆ push_back() [4573/4950]

x species_pp_AUID push_back ( "b5de283f5e1afa4b"  )

◆ push_back() [4574/4950]

x species_pp_groundstate_structure push_back ( "N/A_b5de283f5e1afa4b"  )

◆ push_back() [4575/4950]

x vTITEL push_back ( "PAW_PBEO_h_GW22May2013"  )

◆ push_back() [4576/4950]

x species_pp_version push_back ( "O_h_GW:PAW_PBE:22May2013"  )

◆ push_back() [4577/4950]

x species_pp_AUID push_back ( "840a1d804f0a071b"  )

◆ push_back() [4578/4950]

x species_pp_groundstate_structure push_back ( "N/A_840a1d804f0a071b"  )

◆ push_back() [4579/4950]

x vTITEL push_back ( "PAW_PBEO_h06Feb2004"  )

◆ push_back() [4580/4950]

x species_pp_version push_back ( "O_h:PAW_PBE:06Feb2004"  )

◆ push_back() [4581/4950]

x species_pp_AUID push_back ( "3faeb4e500fb4df7"  )

◆ push_back() [4582/4950]

x species_pp_groundstate_structure push_back ( "N/A_3faeb4e500fb4df7"  )

◆ push_back() [4583/4950]

x species_pp_AUID push_back ( "5c530b0eaed90a00"  )

◆ push_back() [4584/4950]

x vTITEL push_back ( "PAW_PBEO_s_GW10Jan2007"  )

◆ push_back() [4585/4950]

x species_pp_version push_back ( "O_s_GW:PAW_PBE:10Jan2007"  )

◆ push_back() [4586/4950]

x species_pp_AUID push_back ( "79f286b40dceaa0d"  )

◆ push_back() [4587/4950]

x species_pp_groundstate_structure push_back ( "N/A_79f286b40dceaa0d"  )

◆ push_back() [4588/4950]

x species_pp_AUID push_back ( "4a095ffe40846023"  )

◆ push_back() [4589/4950]

x species_pp_groundstate_structure push_back ( "N/A_4a095ffe40846023"  )

◆ push_back() [4590/4950]

x species_pp_AUID push_back ( "0b4b416ff63ebb16"  )

◆ push_back() [4591/4950]

x species_pp_AUID push_back ( "6fba18d27313ce5e"  )

◆ push_back() [4592/4950]

x vTITEL push_back ( "PAW_PBEOs_sv_GW23Mar2010"  )

◆ push_back() [4593/4950]

x species_pp_version push_back ( "Os_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4594/4950]

x species_pp_AUID push_back ( "63300b11641f5a42"  )

◆ push_back() [4595/4950]

x vEATOM push_back ( 2508.  8897)

◆ push_back() [4596/4950]

x species_pp_AUID push_back ( "1e3def5cd17306ba"  )

◆ push_back() [4597/4950]

x species_pp_groundstate_structure push_back ( "N/A_1e3def5cd17306ba"  )

◆ push_back() [4598/4950]

x species_pp_AUID push_back ( "ad926f46c3b22042"  )

◆ push_back() [4599/4950]

x species_pp_groundstate_structure push_back ( "N/A_ad926f46c3b22042"  )

◆ push_back() [4600/4950]

x vTITEL push_back ( "PAW_PBEPb_d_GW14Apr2014"  )

◆ push_back() [4601/4950]

x species_pp_version push_back ( "Pb_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4602/4950]

x species_pp_AUID push_back ( "fff14192b2b4f176"  )

◆ push_back() [4603/4950]

x vEATOM push_back ( 2529.  9788)

◆ push_back() [4604/4950]

x species_pp_AUID push_back ( "3143a75eeaa29ea5"  )

◆ push_back() [4605/4950]

x species_pp_AUID push_back ( "727d5248f9fb2e47"  )

◆ push_back() [4606/4950]

x vTITEL push_back ( "PAW_PBEPb_sv_GW04Apr2014"  )

◆ push_back() [4607/4950]

x species_pp_version push_back ( "Pb_sv_GW:PAW_PBE:04Apr2014"  )

◆ push_back() [4608/4950]

x species_pp_AUID push_back ( "3bda0fd1d9069479"  )

◆ push_back() [4609/4950]

x vEATOM push_back ( 5306.  862)

◆ push_back() [4610/4950]

x vTITEL push_back ( "PAW_PBEPd_GW06Mar2008"  )

◆ push_back() [4611/4950]

x species_pp_version push_back ( "Pd_GW:PAW_PBE:06Mar2008"  )

◆ push_back() [4612/4950]

x species_pp_AUID push_back ( "863baeb4a12a2226"  )

◆ push_back() [4613/4950]

x vTITEL push_back ( "PAW_PBEPd04Jan2005"  )

◆ push_back() [4614/4950]

x species_pp_version push_back ( "Pd:PAW_PBE:04Jan2005"  )

◆ push_back() [4615/4950]

x species_pp_AUID push_back ( "2ef0a2bc50307dc4"  )

◆ push_back() [4616/4950]

x vTITEL push_back ( "PAW_PBEPd_pv28Jan2005"  )

◆ push_back() [4617/4950]

x species_pp_version push_back ( "Pd_pv:PAW_PBE:28Jan2005"  )

◆ push_back() [4618/4950]

x species_pp_AUID push_back ( "35cb7e1d80725a17"  )

◆ push_back() [4619/4950]

x vEATOM push_back ( 2621.  555)

◆ push_back() [4620/4950]

x vTITEL push_back ( "PAW_PBEPd_sv_GW05Dec2013"  )

◆ push_back() [4621/4950]

x species_pp_version push_back ( "Pd_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4622/4950]

x species_pp_AUID push_back ( "78fd29f76da976e8"  )

◆ push_back() [4623/4950]

x vTITEL push_back ( "PAW_PBEP_GW19Mar2012"  )

◆ push_back() [4624/4950]

x species_pp_version push_back ( "P_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [4625/4950]

x species_pp_AUID push_back ( "579c6ad354428db4"  )

◆ push_back() [4626/4950]

x species_pp_groundstate_structure push_back ( "N/A_579c6ad354428db4"  )

◆ push_back() [4627/4950]

x species_pp_AUID push_back ( "d64d49a8028ca2bc"  )

◆ push_back() [4628/4950]

x species_pp_groundstate_structure push_back ( "N/A_d64d49a8028ca2bc"  )

◆ push_back() [4629/4950]

x species_pp_AUID push_back ( "4eb84b87c1dd0621"  )

◆ push_back() [4630/4950]

x species_pp_groundstate_structure push_back ( "N/A_4eb84b87c1dd0621"  )

◆ push_back() [4631/4950]

x vTITEL push_back ( "PAW_PBEPm23Dec2003"  )

◆ push_back() [4632/4950]

x species_pp_version push_back ( "Pm:PAW_PBE:23Dec2003"  )

◆ push_back() [4633/4950]

x species_pp_AUID push_back ( "7ca0fce3a36744ac"  )

◆ push_back() [4634/4950]

x species_pp_groundstate_structure push_back ( "N/A_7ca0fce3a36744ac"  )

◆ push_back() [4635/4950]

x vTITEL push_back ( "PAW_PBEPo_d_GW14Apr2014"  )

◆ push_back() [4636/4950]

x species_pp_version push_back ( "Po_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4637/4950]

x species_pp_AUID push_back ( "13df84f4f3b53e8b"  )

◆ push_back() [4638/4950]

x species_pp_groundstate_structure push_back ( "N/A_13df84f4f3b53e8b"  )

◆ push_back() [4639/4950]

x vEATOM push_back ( 3311.  9272)

◆ push_back() [4640/4950]

x vTITEL push_back ( "PAW_PBEPo_d25May2007"  )

◆ push_back() [4641/4950]

x species_pp_version push_back ( "Po_d:PAW_PBE:25May2007"  )

◆ push_back() [4642/4950]

x species_pp_AUID push_back ( "d322d21d162d7e4c"  )

◆ push_back() [4643/4950]

x species_pp_groundstate_structure push_back ( "N/A_d322d21d162d7e4c"  )

◆ push_back() [4644/4950]

x vEATOM push_back ( 2285.  7805)

◆ push_back() [4645/4950]

x vTITEL push_back ( "PAW_PBEPo10Feb2004"  )

◆ push_back() [4646/4950]

x species_pp_version push_back ( "Po:PAW_PBE:10Feb2004"  )

◆ push_back() [4647/4950]

x species_pp_AUID push_back ( "adbd5dab70c324b9"  )

◆ push_back() [4648/4950]

x species_pp_groundstate_structure push_back ( "N/A_adbd5dab70c324b9"  )

◆ push_back() [4649/4950]

x vEATOM push_back ( 220.  5365)

◆ push_back() [4650/4950]

x vTITEL push_back ( "PAW_PBEPo_sv_GW14Apr2014"  )

◆ push_back() [4651/4950]

x species_pp_version push_back ( "Po_sv_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4652/4950]

x species_pp_AUID push_back ( "e4afb2a58cf62825"  )

◆ push_back() [4653/4950]

x species_pp_groundstate_structure push_back ( "N/A_e4afb2a58cf62825"  )

◆ push_back() [4654/4950]

x vEATOM push_back ( 6535.  4074)

◆ push_back() [4655/4950]

x vTITEL push_back ( "PAW_PBEP06Sep2000"  )

◆ push_back() [4656/4950]

x species_pp_version push_back ( "P:PAW_PBE:06Sep2000"  )

◆ push_back() [4657/4950]

x species_pp_AUID push_back ( "3cafdbeb02f9e951"  )

◆ push_back() [4658/4950]

x species_pp_AUID push_back ( "82f2ee14c4caf04b"  )

◆ push_back() [4659/4950]

x species_pp_groundstate_structure push_back ( "N/A_82f2ee14c4caf04b"  )

◆ push_back() [4660/4950]

x vTITEL push_back ( "PAW_PBEPr23Dec2003"  )

◆ push_back() [4661/4950]

x species_pp_version push_back ( "Pr:PAW_PBE:23Dec2003"  )

◆ push_back() [4662/4950]

x species_pp_AUID push_back ( "7f1d8ecdf47d2865"  )

◆ push_back() [4663/4950]

x species_pp_groundstate_structure push_back ( "N/A_7f1d8ecdf47d2865"  )

◆ push_back() [4664/4950]

x vTITEL push_back ( "PAW_PBEPt_GW10Mar2009"  )

◆ push_back() [4665/4950]

x species_pp push_back ( "Pt_GW"  )

◆ push_back() [4666/4950]

x species_pp_version push_back ( "Pt_GW:PAW_PBE:10Mar2009"  )

◆ push_back() [4667/4950]

x species_pp_AUID push_back ( "fc52fca180d8c423"  )

◆ push_back() [4668/4950]

x vTITEL push_back ( "PAW_PBEPt04Feb2005"  )

◆ push_back() [4669/4950]

x species_pp_version push_back ( "Pt:PAW_PBE:04Feb2005"  )

◆ push_back() [4670/4950]

x species_pp_AUID push_back ( "c67ecad4e9259793"  )

◆ push_back() [4671/4950]

x vTITEL push_back ( "PAW_PBEPt_pv12Dec2005"  )

◆ push_back() [4672/4950]

x species_pp_version push_back ( "Pt_pv:PAW_PBE:12Dec2005"  )

◆ push_back() [4673/4950]

x species_pp_AUID push_back ( "35f9da8fbc175cc5"  )

◆ push_back() [4674/4950]

x vEATOM push_back ( 2428.  2504)

◆ push_back() [4675/4950]

x vTITEL push_back ( "PAW_PBEPt_sv_GW23Mar2010"  )

◆ push_back() [4676/4950]

x species_pp_version push_back ( "Pt_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4677/4950]

x species_pp_AUID push_back ( "cffa53570eebb464"  )

◆ push_back() [4678/4950]

x vEATOM push_back ( 3295.  6393)

◆ push_back() [4679/4950]

x species_pp_AUID push_back ( "b81bdafb067a9111"  )

◆ push_back() [4680/4950]

x species_pp_groundstate_structure push_back ( "N/A_b81bdafb067a9111"  )

◆ push_back() [4681/4950]

x species_pp_AUID push_back ( "7a00774734db6e20"  )

◆ push_back() [4682/4950]

x species_pp_groundstate_structure push_back ( "N/A_7a00774734db6e20"  )

◆ push_back() [4683/4950]

x vTITEL push_back ( "PAW_PBERa_sv29May2007"  )

◆ push_back() [4684/4950]

x species_pp_version push_back ( "Ra_sv:PAW_PBE:29May2007"  )

◆ push_back() [4685/4950]

x species_pp_AUID push_back ( "0d86b1552943ba2a"  )

◆ push_back() [4686/4950]

x species_pp_groundstate_structure push_back ( "N/A_0d86b1552943ba2a"  )

◆ push_back() [4687/4950]

x species_pp_AUID push_back ( "56c0a67400b28556"  )

◆ push_back() [4688/4950]

x species_pp_groundstate_structure push_back ( "N/A_56c0a67400b28556"  )

◆ push_back() [4689/4950]

x vTITEL push_back ( "PAW_PBERb_sv_GW23Mar2010"  )

◆ push_back() [4690/4950]

x species_pp_version push_back ( "Rb_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4691/4950]

x species_pp_AUID push_back ( "f5c73e5243fa4fcc"  )

◆ push_back() [4692/4950]

x species_pp_groundstate_structure push_back ( "N/A_f5c73e5243fa4fcc"  )

◆ push_back() [4693/4950]

x species_pp_AUID push_back ( "d6e349c167183478"  )

◆ push_back() [4694/4950]

x species_pp_groundstate_structure push_back ( "N/A_d6e349c167183478"  )

◆ push_back() [4695/4950]

x species_pp_AUID push_back ( "6c3f2ec3842638b8"  )

◆ push_back() [4696/4950]

x species_pp_AUID push_back ( "3f9c2349a9115560"  )

◆ push_back() [4697/4950]

x vTITEL push_back ( "PAW_PBERe_sv_GW23Mar2010"  )

◆ push_back() [4698/4950]

x species_pp_version push_back ( "Re_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4699/4950]

x species_pp_AUID push_back ( "28be1918e906c6ea"  )

◆ push_back() [4700/4950]

x vEATOM push_back ( 2169.  3978)

◆ push_back() [4701/4950]

x vTITEL push_back ( "PAW_PBERh_GW06Mar2008"  )

◆ push_back() [4702/4950]

x species_pp_version push_back ( "Rh_GW:PAW_PBE:06Mar2008"  )

◆ push_back() [4703/4950]

x species_pp_AUID push_back ( "10b1a1345dd201d9"  )

◆ push_back() [4704/4950]

x vTITEL push_back ( "PAW_PBERh04Feb2005"  )

◆ push_back() [4705/4950]

x species_pp_version push_back ( "Rh:PAW_PBE:04Feb2005"  )

◆ push_back() [4706/4950]

x species_pp_AUID push_back ( "dc3fbc9801231714"  )

◆ push_back() [4707/4950]

x vTITEL push_back ( "PAW_PBERh_pv25Jan2005"  )

◆ push_back() [4708/4950]

x species_pp_version push_back ( "Rh_pv:PAW_PBE:25Jan2005"  )

◆ push_back() [4709/4950]

x species_pp_AUID push_back ( "98605c42de12449b"  )

◆ push_back() [4710/4950]

x vEATOM push_back ( 2226.  4782)

◆ push_back() [4711/4950]

x vTITEL push_back ( "PAW_PBERh_sv_GW05Dec2013"  )

◆ push_back() [4712/4950]

x species_pp_version push_back ( "Rh_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4713/4950]

x species_pp_AUID push_back ( "84e12fc493054c95"  )

◆ push_back() [4714/4950]

x vEATOM push_back ( 3025.  2155)

◆ push_back() [4715/4950]

x vTITEL push_back ( "PAW_PBERn_d_GW14Apr2014"  )

◆ push_back() [4716/4950]

x species_pp_version push_back ( "Rn_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4717/4950]

x species_pp_AUID push_back ( "abe3f353764b7e31"  )

◆ push_back() [4718/4950]

x species_pp_groundstate_structure push_back ( "N/A_abe3f353764b7e31"  )

◆ push_back() [4719/4950]

x vEATOM push_back ( 3030.  713)

◆ push_back() [4720/4950]

x vTITEL push_back ( "PAW_PBERn28Aug2006"  )

◆ push_back() [4721/4950]

x species_pp_version push_back ( "Rn:PAW_PBE:28Aug2006"  )

◆ push_back() [4722/4950]

x species_pp_AUID push_back ( "24f5e31bf1323508"  )

◆ push_back() [4723/4950]

x species_pp_groundstate_structure push_back ( "N/A_24f5e31bf1323508"  )

◆ push_back() [4724/4950]

x vTITEL push_back ( "PAW_PBERn_sv_GW14Apr2014"  )

◆ push_back() [4725/4950]

x species_pp_version push_back ( "Rn_sv_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4726/4950]

x species_pp_AUID push_back ( "fd5b919041e7ced1"  )

◆ push_back() [4727/4950]

x species_pp_groundstate_structure push_back ( "N/A_fd5b919041e7ced1"  )

◆ push_back() [4728/4950]

x vEATOM push_back ( 7927.  0395)

◆ push_back() [4729/4950]

x vTITEL push_back ( "PAW_PBERu04Feb2005"  )

◆ push_back() [4730/4950]

x species_pp_version push_back ( "Ru:PAW_PBE:04Feb2005"  )

◆ push_back() [4731/4950]

x species_pp_AUID push_back ( "ee46e79f573bbba1"  )

◆ push_back() [4732/4950]

x vTITEL push_back ( "PAW_PBERu_pv28Jan2005"  )

◆ push_back() [4733/4950]

x species_pp_version push_back ( "Ru_pv:PAW_PBE:28Jan2005"  )

◆ push_back() [4734/4950]

x species_pp_AUID push_back ( "6a824616a7311021"  )

◆ push_back() [4735/4950]

x vEATOM push_back ( 1873.  4746)

◆ push_back() [4736/4950]

x vTITEL push_back ( "PAW_PBERu_sv_GW05Dec2013"  )

◆ push_back() [4737/4950]

x species_pp_version push_back ( "Ru_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4738/4950]

x species_pp_AUID push_back ( "c476a1b5dba68ade"  )

◆ push_back() [4739/4950]

x vEATOM push_back ( 2594.  8033)

◆ push_back() [4740/4950]

x vTITEL push_back ( "PAW_GGARu_sv28Jan2005"  )

◆ push_back() [4741/4950]

x species_pp_version push_back ( "Ru_sv:PAW_GGA:28Jan2005"  )

◆ push_back() [4742/4950]

x species_pp_AUID push_back ( "1550a87ae48844e0"  )

◆ push_back() [4743/4950]

x vTITEL push_back ( "PAW_PBESb_d_GW15Mar2013"  )

◆ push_back() [4744/4950]

x species_pp_version push_back ( "Sb_d_GW:PAW_PBE:15Mar2013"  )

◆ push_back() [4745/4950]

x species_pp_AUID push_back ( "4f26fc9dd3fb360f"  )

◆ push_back() [4746/4950]

x species_pp_groundstate_structure push_back ( "N/A_4f26fc9dd3fb360f"  )

◆ push_back() [4747/4950]

x vEATOM push_back ( 2243.  711)

◆ push_back() [4748/4950]

x vTITEL push_back ( "PAW_PBESb_GW21Mar2012"  )

◆ push_back() [4749/4950]

x species_pp_version push_back ( "Sb_GW:PAW_PBE:21Mar2012"  )

◆ push_back() [4750/4950]

x species_pp_AUID push_back ( "3fec6f2ffb9c9ff7"  )

◆ push_back() [4751/4950]

x species_pp_groundstate_structure push_back ( "N/A_3fec6f2ffb9c9ff7"  )

◆ push_back() [4752/4950]

x species_pp_AUID push_back ( "bbf81761207d2817"  )

◆ push_back() [4753/4950]

x vTITEL push_back ( "PAW_PBESb_sv_GW22Nov2013"  )

◆ push_back() [4754/4950]

x species_pp_version push_back ( "Sb_sv_GW:PAW_PBE:22Nov2013"  )

◆ push_back() [4755/4950]

x species_pp_AUID push_back ( "1e481bb188c0855d"  )

◆ push_back() [4756/4950]

x species_pp_groundstate_structure push_back ( "N/A_1e481bb188c0855d"  )

◆ push_back() [4757/4950]

x vEATOM push_back ( 6571.  3498)

◆ push_back() [4758/4950]

x vTITEL push_back ( "PAW_PBESc04Feb2005"  )

◆ push_back() [4759/4950]

x species_pp_version push_back ( "Sc:PAW_PBE:04Feb2005"  )

◆ push_back() [4760/4950]

x species_pp_AUID push_back ( "69bd66903db1e199"  )

◆ push_back() [4761/4950]

x vTITEL push_back ( "PAW_PBESc_sv_GW05Dec2013"  )

◆ push_back() [4762/4950]

x species_pp_version push_back ( "Sc_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4763/4950]

x species_pp_AUID push_back ( "bbde08d55886a708"  )

◆ push_back() [4764/4950]

x vEATOM push_back ( 1270.  82)

◆ push_back() [4765/4950]

x species_pp_AUID push_back ( "83d4f13df3294a60"  )

◆ push_back() [4766/4950]

x vTITEL push_back ( "PAW_PBESe_GW20Mar2012"  )

◆ push_back() [4767/4950]

x species_pp_version push_back ( "Se_GW:PAW_PBE:20Mar2012"  )

◆ push_back() [4768/4950]

x species_pp_AUID push_back ( "e07be7e8f885f5e4"  )

◆ push_back() [4769/4950]

x species_pp_groundstate_structure push_back ( "N/A_e07be7e8f885f5e4"  )

◆ push_back() [4770/4950]

x species_pp_AUID push_back ( "00143077dee7333f"  )

◆ push_back() [4771/4950]

x vTITEL push_back ( "PAW_PBESe_sv_GW21Nov2013"  )

◆ push_back() [4772/4950]

x species_pp_version push_back ( "Se_sv_GW:PAW_PBE:21Nov2013"  )

◆ push_back() [4773/4950]

x species_pp_AUID push_back ( "b04f2b0d4828a903"  )

◆ push_back() [4774/4950]

x species_pp_groundstate_structure push_back ( "N/A_b04f2b0d4828a903"  )

◆ push_back() [4775/4950]

x vEATOM push_back ( 10170.  6633)

◆ push_back() [4776/4950]

x vTITEL push_back ( "PAW_PBES_GW19Mar2012"  )

◆ push_back() [4777/4950]

x species_pp_version push_back ( "S_GW:PAW_PBE:19Mar2012"  )

◆ push_back() [4778/4950]

x species_pp_AUID push_back ( "ae81169b759a46a8"  )

◆ push_back() [4779/4950]

x species_pp_groundstate_structure push_back ( "N/A_ae81169b759a46a8"  )

◆ push_back() [4780/4950]

x species_pp_AUID push_back ( "40679994b360338c"  )

◆ push_back() [4781/4950]

x species_pp_groundstate_structure push_back ( "N/A_40679994b360338c"  )

◆ push_back() [4782/4950]

x vTITEL push_back ( "PAW_PBESi_GW04May2012"  )

◆ push_back() [4783/4950]

x species_pp_version push_back ( "Si_GW:PAW_PBE:04May2012"  )

◆ push_back() [4784/4950]

x species_pp_AUID push_back ( "6af63b41a1e485ff"  )

◆ push_back() [4785/4950]

x species_pp_groundstate_structure push_back ( "N/A_6af63b41a1e485ff"  )

◆ push_back() [4786/4950]

x species_pp_AUID push_back ( "afc7580b135e98ce"  )

◆ push_back() [4787/4950]

x vTITEL push_back ( "PAW_PBESi_sv_GW29Sep2009"  )

◆ push_back() [4788/4950]

x species_pp_version push_back ( "Si_sv_GW:PAW_PBE:29Sep2009"  )

◆ push_back() [4789/4950]

x species_pp_AUID push_back ( "9af06dcd5ce81bc3"  )

◆ push_back() [4790/4950]

x species_pp_groundstate_structure push_back ( "N/A_9af06dcd5ce81bc3"  )

◆ push_back() [4791/4950]

x vEATOM push_back ( 2779.  1055)

◆ push_back() [4792/4950]

x species_pp_AUID push_back ( "5b4edfcf9bf433f3"  )

◆ push_back() [4793/4950]

x species_pp_groundstate_structure push_back ( "N/A_5b4edfcf9bf433f3"  )

◆ push_back() [4794/4950]

x vTITEL push_back ( "PAW_PBESm21Nov2014"  )

◆ push_back() [4795/4950]

x species_pp_version push_back ( "Sm:PAW_PBE:21Nov2014"  )

◆ push_back() [4796/4950]

x species_pp_AUID push_back ( "0985a2959768335b"  )

◆ push_back() [4797/4950]

x species_pp_groundstate_structure push_back ( "N/A_0985a2959768335b"  )

◆ push_back() [4798/4950]

x vTITEL push_back ( "PAW_PBESn_d_GW15Mar2013"  )

◆ push_back() [4799/4950]

x species_pp_version push_back ( "Sn_d_GW:PAW_PBE:15Mar2013"  )

◆ push_back() [4800/4950]

x species_pp_AUID push_back ( "9a9ccd880f536416"  )

◆ push_back() [4801/4950]

x species_pp_groundstate_structure push_back ( "N/A_9a9ccd880f536416"  )

◆ push_back() [4802/4950]

x species_pp_AUID push_back ( "6431a791389bb4f7"  )

◆ push_back() [4803/4950]

x species_pp_AUID push_back ( "4ddcdf83c7589054"  )

◆ push_back() [4804/4950]

x vTITEL push_back ( "PAW_PBESn_sv_GW22Nov2013"  )

◆ push_back() [4805/4950]

x species_pp_version push_back ( "Sn_sv_GW:PAW_PBE:22Nov2013"  )

◆ push_back() [4806/4950]

x species_pp_AUID push_back ( "e1f5830bb7259c8f"  )

◆ push_back() [4807/4950]

x species_pp_groundstate_structure push_back ( "N/A_e1f5830bb7259c8f"  )

◆ push_back() [4808/4950]

x vEATOM push_back ( 5862.  8354)

◆ push_back() [4809/4950]

x vTITEL push_back ( "PAW_PBES06Sep2000"  )

◆ push_back() [4810/4950]

x species_pp_version push_back ( "S:PAW_PBE:06Sep2000"  )

◆ push_back() [4811/4950]

x species_pp_AUID push_back ( "a18b03f7564daaaa"  )

◆ push_back() [4812/4950]

x vTITEL push_back ( "PAW_PBESr_sv_GW23Mar2010"  )

◆ push_back() [4813/4950]

x species_pp_version push_back ( "Sr_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4814/4950]

x species_pp_AUID push_back ( "a447636c05ea63c7"  )

◆ push_back() [4815/4950]

x vEATOM push_back ( 838.  2651)

◆ push_back() [4816/4950]

x species_pp_AUID push_back ( "403b3e0afc9132cc"  )

◆ push_back() [4817/4950]

x species_pp_AUID push_back ( "096d94d0306813d6"  )

◆ push_back() [4818/4950]

x species_pp_AUID push_back ( "2287798c5502b426"  )

◆ push_back() [4819/4950]

x vTITEL push_back ( "PAW_PBETa_sv_GW23Mar2010"  )

◆ push_back() [4820/4950]

x species_pp_version push_back ( "Ta_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4821/4950]

x species_pp_AUID push_back ( "bcd3b7b7689d66d7"  )

◆ push_back() [4822/4950]

x vEATOM push_back ( 1591.  0418)

◆ push_back() [4823/4950]

x species_pp_AUID push_back ( "ed7ad539b010c52e"  )

◆ push_back() [4824/4950]

x species_pp_groundstate_structure push_back ( "N/A_ed7ad539b010c52e"  )

◆ push_back() [4825/4950]

x vTITEL push_back ( "PAW_PBETb23Dec2003"  )

◆ push_back() [4826/4950]

x species_pp_version push_back ( "Tb:PAW_PBE:23Dec2003"  )

◆ push_back() [4827/4950]

x species_pp_AUID push_back ( "aa67c66116f49cc9"  )

◆ push_back() [4828/4950]

x species_pp_groundstate_structure push_back ( "N/A_aa67c66116f49cc9"  )

◆ push_back() [4829/4950]

x vEATOM push_back ( 3532.  1156)

◆ push_back() [4830/4950]

x vTITEL push_back ( "PAW_PBETc04Feb2005"  )

◆ push_back() [4831/4950]

x species_pp_version push_back ( "Tc:PAW_PBE:04Feb2005"  )

◆ push_back() [4832/4950]

x species_pp_AUID push_back ( "5751220a43dddd9b"  )

◆ push_back() [4833/4950]

x vTITEL push_back ( "PAW_PBETc_pv04Feb2005"  )

◆ push_back() [4834/4950]

x species_pp_version push_back ( "Tc_pv:PAW_PBE:04Feb2005"  )

◆ push_back() [4835/4950]

x species_pp_AUID push_back ( "5c4bf0cceb477531"  )

◆ push_back() [4836/4950]

x vEATOM push_back ( 1560.  2019)

◆ push_back() [4837/4950]

x vTITEL push_back ( "PAW_PBETc_sv_GW05Dec2013"  )

◆ push_back() [4838/4950]

x species_pp_version push_back ( "Tc_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4839/4950]

x species_pp_AUID push_back ( "69d305a31cd8c1fa"  )

◆ push_back() [4840/4950]

x vEATOM push_back ( 2207.  6909)

◆ push_back() [4841/4950]

x vTITEL push_back ( "PAW_PBETc_sv23Mar2010"  )

◆ push_back() [4842/4950]

x species_pp_version push_back ( "Tc_sv:PAW_PBE:23Mar2010"  )

◆ push_back() [4843/4950]

x species_pp_AUID push_back ( "3816a915d663bd59"  )

◆ push_back() [4844/4950]

x vTITEL push_back ( "PAW_PBETe_GW22Mar2012"  )

◆ push_back() [4845/4950]

x species_pp_version push_back ( "Te_GW:PAW_PBE:22Mar2012"  )

◆ push_back() [4846/4950]

x species_pp_AUID push_back ( "7adcd1313d1499f5"  )

◆ push_back() [4847/4950]

x species_pp_groundstate_structure push_back ( "N/A_7adcd1313d1499f5"  )

◆ push_back() [4848/4950]

x species_pp_AUID push_back ( "8d2f6568d1d06421"  )

◆ push_back() [4849/4950]

x vTITEL push_back ( "PAW_PBETe_sv_GW22Nov2013"  )

◆ push_back() [4850/4950]

x species_pp_version push_back ( "Te_sv_GW:PAW_PBE:22Nov2013"  )

◆ push_back() [4851/4950]

x species_pp_AUID push_back ( "8bae5759d6396694"  )

◆ push_back() [4852/4950]

x species_pp_groundstate_structure push_back ( "N/A_8bae5759d6396694"  )

◆ push_back() [4853/4950]

x vEATOM push_back ( 7330.  6851)

◆ push_back() [4854/4950]

x species_pp_AUID push_back ( "afbdbb60cb7fea6e"  )

◆ push_back() [4855/4950]

x species_pp_groundstate_structure push_back ( "N/A_afbdbb60cb7fea6e"  )

◆ push_back() [4856/4950]

x species_pp_AUID push_back ( "1fb4d3c05d6ae40a"  )

◆ push_back() [4857/4950]

x species_pp_groundstate_structure push_back ( "N/A_1fb4d3c05d6ae40a"  )

◆ push_back() [4858/4950]

x species_pp_AUID push_back ( "e19a9be220c9f36d"  )

◆ push_back() [4859/4950]

x species_pp_AUID push_back ( "571036b918ee987a"  )

◆ push_back() [4860/4950]

x vTITEL push_back ( "PAW_PBETi_sv_GW05Dec2013"  )

◆ push_back() [4861/4950]

x species_pp_version push_back ( "Ti_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4862/4950]

x species_pp_AUID push_back ( "60802bd648654a15"  )

◆ push_back() [4863/4950]

x vEATOM push_back ( 1585.  8558)

◆ push_back() [4864/4950]

x vTITEL push_back ( "PAW_PBETi_sv26Sep2005"  )

◆ push_back() [4865/4950]

x species_pp_version push_back ( "Ti_sv:PAW_PBE:26Sep2005"  )

◆ push_back() [4866/4950]

x species_pp_AUID push_back ( "9695cfc266c5809c"  )

◆ push_back() [4867/4950]

x vTITEL push_back ( "PAW_PBETl_d_GW14Apr2014"  )

◆ push_back() [4868/4950]

x species_pp_version push_back ( "Tl_d_GW:PAW_PBE:14Apr2014"  )

◆ push_back() [4869/4950]

x species_pp_AUID push_back ( "8896eeaa0ff47c1f"  )

◆ push_back() [4870/4950]

x species_pp_groundstate_structure push_back ( "N/A_8896eeaa0ff47c1f"  )

◆ push_back() [4871/4950]

x vEATOM push_back ( 2189.  1943)

◆ push_back() [4872/4950]

x species_pp_AUID push_back ( "4f0fac6e26fd86a9"  )

◆ push_back() [4873/4950]

x species_pp_AUID push_back ( "0e2337aac65480f2"  )

◆ push_back() [4874/4950]

x species_pp_groundstate_structure push_back ( "N/A_0e2337aac65480f2"  )

◆ push_back() [4875/4950]

x vTITEL push_back ( "PAW_PBETl_sv_GW16Apr2014"  )

◆ push_back() [4876/4950]

x species_pp_version push_back ( "Tl_sv_GW:PAW_PBE:16Apr2014"  )

◆ push_back() [4877/4950]

x species_pp_AUID push_back ( "3234a754ecaba8c8"  )

◆ push_back() [4878/4950]

x species_pp_groundstate_structure push_back ( "N/A_3234a754ecaba8c8"  )

◆ push_back() [4879/4950]

x vEATOM push_back ( 4750.  8453)

◆ push_back() [4880/4950]

x vTITEL push_back ( "PAW_PBETm_320Jan2003"  )

◆ push_back() [4881/4950]

x species_pp_version push_back ( "Tm_3:PAW_PBE:20Jan2003"  )

◆ push_back() [4882/4950]

x species_pp_AUID push_back ( "79d03b938c691891"  )

◆ push_back() [4883/4950]

x species_pp_groundstate_structure push_back ( "N/A_79d03b938c691891"  )

◆ push_back() [4884/4950]

x vTITEL push_back ( "PAW_PBETm23Dec2003"  )

◆ push_back() [4885/4950]

x species_pp_version push_back ( "Tm:PAW_PBE:23Dec2003"  )

◆ push_back() [4886/4950]

x species_pp_AUID push_back ( "85bd67fcb39034b7"  )

◆ push_back() [4887/4950]

x species_pp_groundstate_structure push_back ( "N/A_85bd67fcb39034b7"  )

◆ push_back() [4888/4950]

x species_pp_AUID push_back ( "8c6fcf3cba9760b9"  )

◆ push_back() [4889/4950]

x species_pp_groundstate_structure push_back ( "N/A_8c6fcf3cba9760b9"  )

◆ push_back() [4890/4950]

x species_pp_AUID push_back ( "d7d8c006e5529a80"  )

◆ push_back() [4891/4950]

x species_pp_groundstate_structure push_back ( "N/A_d7d8c006e5529a80"  )

◆ push_back() [4892/4950]

x species_pp_AUID push_back ( "62ba629379463606"  )

◆ push_back() [4893/4950]

x species_pp_AUID push_back ( "ff7f68300ba3e357"  )

◆ push_back() [4894/4950]

x vTITEL push_back ( "PAW_PBEV_sv_GW05Dec2013"  )

◆ push_back() [4895/4950]

x species_pp_version push_back ( "V_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4896/4950]

x species_pp_AUID push_back ( "72baf87216b94021"  )

◆ push_back() [4897/4950]

x vTITEL push_back ( "PAW_PBEV_sv02Aug2007"  )

◆ push_back() [4898/4950]

x species_pp_version push_back ( "V_sv:PAW_PBE:02Aug2007"  )

◆ push_back() [4899/4950]

x species_pp_AUID push_back ( "46928c16c2f8a488"  )

◆ push_back() [4900/4950]

x species_pp_AUID push_back ( "b99d5a263927c2ea"  )

◆ push_back() [4901/4950]

x vTITEL push_back ( "PAW_PBEW_sv_GW23Mar2010"  )

◆ push_back() [4902/4950]

x species_pp_version push_back ( "W_sv_GW:PAW_PBE:23Mar2010"  )

◆ push_back() [4903/4950]

x species_pp_AUID push_back ( "cdaff66d42eb21cb"  )

◆ push_back() [4904/4950]

x vEATOM push_back ( 1863.  8917)

◆ push_back() [4905/4950]

x vTITEL push_back ( "PAW_PBEW_sv04Sep2015"  )

◆ push_back() [4906/4950]

x species_pp_version push_back ( "W_sv:PAW_PBE:04Sep2015"  )

◆ push_back() [4907/4950]

x species_pp_AUID push_back ( "1d8c010cef748b9c"  )

◆ push_back() [4908/4950]

x vTITEL push_back ( "PAW_PBEXe_GW08Jan2009"  )

◆ push_back() [4909/4950]

x species_pp_version push_back ( "Xe_GW:PAW_PBE:08Jan2009"  )

◆ push_back() [4910/4950]

x species_pp_AUID push_back ( "ae23265533bce8f5"  )

◆ push_back() [4911/4950]

x species_pp_groundstate_structure push_back ( "N/A_ae23265533bce8f5"  )

◆ push_back() [4912/4950]

x species_pp_AUID push_back ( "c02f007fc5b0452c"  )

◆ push_back() [4913/4950]

x species_pp_groundstate_structure push_back ( "N/A_c02f007fc5b0452c"  )

◆ push_back() [4914/4950]

x vTITEL push_back ( "PAW_PBEXe_sv_GW17Apr2014"  )

◆ push_back() [4915/4950]

x species_pp_version push_back ( "Xe_sv_GW:PAW_PBE:17Apr2014"  )

◆ push_back() [4916/4950]

x species_pp_AUID push_back ( "133c9ead41c747b4"  )

◆ push_back() [4917/4950]

x species_pp_groundstate_structure push_back ( "N/A_133c9ead41c747b4"  )

◆ push_back() [4918/4950]

x vEATOM push_back ( 9008.  2142)

◆ push_back() [4919/4950]

x species_pp_AUID push_back ( "a2a66bbb705fd114"  )

◆ push_back() [4920/4950]

x vEATOM push_back ( 572.  3552)

◆ push_back() [4921/4950]

x vTITEL push_back ( "PAW_PBEYb_308Jul2013"  )

◆ push_back() [4922/4950]

x species_pp push_back ( "Yb_3"  )

◆ push_back() [4923/4950]

x species_pp_version push_back ( "Yb_3:PAW_PBE:08Jul2013"  )

◆ push_back() [4924/4950]

x species_pp_AUID push_back ( "d4d1484e34700879"  )

◆ push_back() [4925/4950]

x vEATOM push_back ( 693.  5759)

◆ push_back() [4926/4950]

x vTITEL push_back ( "PAW_PBEYb23Dec2003"  )

◆ push_back() [4927/4950]

x species_pp_version push_back ( "Yb:PAW_PBE:23Dec2003"  )

◆ push_back() [4928/4950]

x species_pp_AUID push_back ( "a73c5ae431db4485"  )

◆ push_back() [4929/4950]

x species_pp_groundstate_structure push_back ( "N/A_a73c5ae431db4485"  )

◆ push_back() [4930/4950]

x vTITEL push_back ( "PAW_PBEY_sv_GW05Dec2013"  )

◆ push_back() [4931/4950]

x species_pp_version push_back ( "Y_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4932/4950]

x species_pp_AUID push_back ( "3189f0e60a077125"  )

◆ push_back() [4933/4950]

x vTITEL push_back ( "PAW_PBEY_sv25May2007"  )

◆ push_back() [4934/4950]

x species_pp_version push_back ( "Y_sv:PAW_PBE:25May2007"  )

◆ push_back() [4935/4950]

x species_pp_AUID push_back ( "2fb876577258940d"  )

◆ push_back() [4936/4950]

x vTITEL push_back ( "PAW_PBEZn_GW09Oct2010"  )

◆ push_back() [4937/4950]

x species_pp_version push_back ( "Zn_GW:PAW_PBE:09Oct2010"  )

◆ push_back() [4938/4950]

x species_pp_AUID push_back ( "c9d470aabc061907"  )

◆ push_back() [4939/4950]

x vEATOM push_back ( 1748.  8345)

◆ push_back() [4940/4950]

x species_pp_AUID push_back ( "7ed9d78dd30715fd"  )

◆ push_back() [4941/4950]

x vTITEL push_back ( "PAW_PBEZn_sv_GW05Dec2013"  )

◆ push_back() [4942/4950]

x species_pp_version push_back ( "Zn_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4943/4950]

x species_pp_AUID push_back ( "53d23506232b67ac"  )

◆ push_back() [4944/4950]

x vTITEL push_back ( "PAW_PBEZr_sv_GW05Dec2013"  )

◆ push_back() [4945/4950]

x species_pp_version push_back ( "Zr_sv_GW:PAW_PBE:05Dec2013"  )

◆ push_back() [4946/4950]

x species_pp_AUID push_back ( "4b771ea128970dd1"  )

◆ push_back() [4947/4950]

x vEATOM push_back ( 1282.  4732)

◆ push_back() [4948/4950]

x vTITEL push_back ( "PAW_PBEZr_sv04Jan2005"  )

◆ push_back() [4949/4950]

x species_pp_version push_back ( "Zr_sv:PAW_PBE:04Jan2005"  )

◆ push_back() [4950/4950]

x species_pp_AUID push_back ( "a3ef4a907c7b4c96"  )

Variable Documentation

◆ filename

x filename ="/common/VASP/pot_LDA/potcar.Apr00/Ag/POTCAR"

◆ AUID

x AUID ="639bb9917452d998"